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N-Cyclopropyl-3-nitrobenzamide

View entire compound with spectra: 1 NMR, and 1 FTIR

N-Cyclopropyl-3-nitrobenzamide
SpectraBase Compound ID 7uwfpa3vx4h
InChI InChI=1S/C10H10N2O3/c13-10(11-8-4-5-8)7-2-1-3-9(6-7)12(14)15/h1-3,6,8H,4-5H2,(H,11,13)
InChIKey BAUAOOIIPHFRKR-UHFFFAOYSA-N
Mol Weight 206.2 g/mol
Molecular Formula C10H10N2O3
Exact Mass 206.069142 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1KIKzfEz9CJ
Name N-Cyclopropyl-3-nitrobenzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.069142187 u
Formula C10H10N2O3
InChI InChI=1S/C10H10N2O3/c13-10(11-8-4-5-8)7-2-1-3-9(6-7)12(14)15/h1-3,6,8H,4-5H2,(H,11,13)
InChIKey BAUAOOIIPHFRKR-UHFFFAOYSA-N
Molecular Weight 206.201 g/mol
SMILES C(NC1CC1)(=O)C1=CC(N(=O)=O)=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.880117