Best Nmr Apps

62+ iOS apps curated and reviewed

4.6 avg rating
18 free apps
Updated August 2026

Every iPhone needs a few good nmr apps. We benchmark 62+ of them on App Store rating, freshness, and pricing, then surface the standouts so you don't have to scroll the App Store yourself.

Compare top Nmr Apps (August 2026)

#AppPriceRatingAdsIn-App PurchasesUpdated
1Orange NMROrange NMRFree4.6★ (10)NoYesJul 2026
2A Level NMRA Level NMRFreeYesNoJun 2026
3NMR Solvent PeaksNMR Solvent PeaksFree5.0★ (11)NoNoMay 2026
4All NMRAll NMRFree5.0★ (2)NoMay 2026
5Mastering SpectroscopyMastering SpectroscopyFree3.3★ (6)NoYesMay 2026
6Pure NMRPure NMRFree was $2.99NoNoMay 2026
7Simply 1H NMR TutorialSimply 1H NMR TutorialFreeNoNoMay 2026
8NMR TutorNMR TutorFree5.0★ (1)NoNoAug 2026

Top Picks for Nmr

Orange NMR#1

Orange NMR by Kirill Blinov

Editor's Choice
📚 Education
4.6(10 ratings)
FreeIn-App Purchases
Orange NMR screenshot 1
Orange NMR screenshot 2
Orange NMR screenshot 3
Orange NMR screenshot 4
Orange NMR screenshot 5

Predict 13C and 1H NMR spectra by drawing molecular structures. Offers instant spectrum recalculation, iCloud synchronization across devices, and PDF report generation. Ideal for chemists and students needing quick spectral analysis.

NMR Solvent Peaks#3

NMR Solvent Peaks by Lucas Moore

Worth Considering
🔧 Utilities
5.0(11 ratings)
Free
NMR Solvent Peaks screenshot 1
NMR Solvent Peaks screenshot 2
NMR Solvent Peaks screenshot 3

This utility helps organic chemists quickly identify potential impurities by searching a database of NMR data. Users can input solvent, peak multiplicity, and location to find candidate impurities. It supports both proton and carbon data searches.

More Nmr apps to explore

4
All NMR
All NMR
All NMR
by Kirill Blinov
Free

Predict ¹³C and ¹H NMR spectra by drawing chemical structures. Offers instant recalculation, iCloud synchronization across devices, and PDF report generation. Features zoomable spectra and structures with chemical shift values displayed on the structure.

Predict ¹³C and ¹H NMR spectraDraw chemical structuresInstant spectrum recalculation
📚 Education
(2)
free
5
Mastering Spectroscopy
Mastering Spectroscopy
Mastering Spectroscopy
by Onlea Enterprises Inc.
Free

Practice organic chemistry by analyzing IR, NMR, and mass spectrum data. Identify functional groups and proton types in graphs to build organic compounds.

Analyze IR, NMR, and mass spectrum dataIdentify functional groupsIdentify proton types
📚 Education
(6)
free with in-app purchases
6
Pure NMR
Pure NMR
Pure NMR
NMR Impurity Reference Guide
Free
$2.99 | 100% OFF
📚 Education
(0)
7
Simply 1H NMR Tutorial
Simply 1H NMR Tutorial
Simply 1H NMR Tutorial
by Yue-Ling Wong
Free
📚 Education
(0)
8
NMR Tutor
NMR Tutor
NMR Tutor
NMR FID learning lab
Free

Explore NMR data acquisition and signal processing with interactive simulations. Adjust parameters like noise, apodization, and phase to observe immediate effects on FID and spectra. Learn about common artifacts and advanced concepts like spin-spin coupling.

Interactive FID and spectra simulationsAdjustable peak positions and decayNoise and apodization control
📚 Education
(1)
free
9
NMR Freq. Table
NMR Freq. Table
NMR Freq. Table
Nuclear Magnetic Resonance
$0.99
$2.99 | 67% OFF
🔧 Utilities
(0)
10
NMR Calculator 2
NMR Calculator 2
NMR Calculator 2
by Jae-Seung Lee
Free
📚 Education
(0)
11
Chemical Detectives
Chemical Detectives
Chemical Detectives
by Darren Smith
Free

Become a 'chemical detective' by solving organic molecule structures using experimental data like spectroscopy and microanalysis. This app also teaches you how to name molecules and allows you to challenge friends to timed duels.

Solve molecular structuresUtilize spectroscopy dataLearn organic molecule naming
📚 Education
(3)
free
12
NMR Celular
NMR Celular
NMR Celular
by Pagtel Servicos de Telecomunicacoes Inteligentes Ltda
Free
🛍️ Shopping
(0)
13
JEOL USA Periodic Table
JEOL USA Periodic Table
JEOL USA Periodic Table
MS, EDS, NMR data
Free

Access specialized periodic tables for mass spectrometry, EDS, and NMR. View isotopic abundances, x-ray energies, and NMR isotope frequencies for each element. Explore detailed information by interacting with elements and charts.

Multiple periodic table views (MS, EDS, NMR)View isotopic abundances and exact massesAccess characteristic x-ray energies
🔍 Reference
(4)
free
14
Find Molecule
Find Molecule
Find Molecule
by Kirill Blinov
Free

Identify chemical structures using NMR data and mass spectrometry. Instantly search a vast database of known compounds with direct links to their PubChem records.

Identify structures by ¹³C NMR shiftsIdentify structures by monoisotopic mass (m/z)Search database of 33 million known structures
📊 Productivity
(1)
free
15
No More Robocalls
No More Robocalls
No More Robocalls
Robocall blocking app
Free

This application aims to completely eliminate unwanted robocalls, a common annoyance for many. It offers a 100% effective solution to block all incoming robocalls, unlike other apps that only block a portion.

100% robocall blockingEliminates all unwanted callsCounteracts robocall inefficiencies
💼 Business
(5)
subscription
16
Chemistry Toolbox
Chemistry Toolbox
Chemistry Toolbox
by Florent Breton
Free
📚 Education
(0)
17
Natural Products
Natural Products
Natural Products
by Kirill Blinov
Free

Instantly search a vast database of natural products using chemical shifts and mass spectrometry data. Access links to external databases like PubChem for detailed compound information.

Search by ¹³C NMR chemical shiftsSearch by monoisotopic mass (m/z)Database of 2.4 million compounds
📊 Productivity
(1)
free
18
Organic Chemistry - Octet
Organic Chemistry - Octet
Organic Chemistry - Octet
Reactions, Synthesis & Study
Free
📚 Education
(0)
19
iSpartan
iSpartan
iSpartan
by Wavefunction, Inc.
$19.99

This app enables chemists to perform molecular modeling on mobile devices. It allows for the creation of molecules through 2D sketching, conversion to 3D structures, and calculation of properties. Access a database of 5,000 molecules for spectra and other atomic data.

2D sketching to 3D structure conversionConformational analysisAccess to 5,000 molecule database
📊 Productivity
(12)
paid
20
Dragonfly Wellness
Dragonfly Wellness
Dragonfly Wellness
Dragonfly
Free
🏥 Medical
(0)

FAQ about Nmr

What are the best nmr apps for iPhone?
Orange NMR tops our nmr apps ranking as of August 2026, with a 4.6-star average from 10 App Store ratings, and it's free to download.
Yes — 18 of the top nmr apps we rank are free to download, including Orange NMR and A Level NMR.
Orange NMR has no ads and offers in-app purchases, according to its App Store listing as of August 2026.
We track 62+ nmr apps on the iOS App Store as of August 2026, ranked by rating, recency, and analysis of real user reviews.
Orange NMR is used to predict 13C and 1H NMR spectra by allowing users to draw molecular structures. It provides instant spectrum recalculation and can generate PDF reports.
The algorithm in Orange NMR has an accuracy of about 1.9 ppm for 13C and 0.21 ppm for 1H, with RMSD values of 3.4 and 0.31 ppm, respectively.

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