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2-amino-N-cyclohexyl-5-nitrobenzamide
SpectraBase Compound ID 5BQ5VthRWoR
InChI InChI=1S/C13H17N3O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9/h6-9H,1-5,14H2,(H,15,17)
InChIKey HHNYGURINVVDCA-UHFFFAOYSA-N
Mol Weight 263.3 g/mol
Molecular Formula C13H17N3O3
Exact Mass 263.126991 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID BIe2BVFeXPl
Name 2-Amino-N-cyclohexyl-5-nitrobenzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.126991416 u
Formula C13H17N3O3
InChI InChI=1S/C13H17N3O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9/h6-9H,1-5,14H2,(H,15,17)
InChIKey HHNYGURINVVDCA-UHFFFAOYSA-N
Molecular Weight 263.297 g/mol
SMILES N(C(C=1C=C(C=CC1N)N(=O)=O)=O)C1CCCCC1
Spectrum/Structure Validation Score (Raman) 0.96756