For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N-(n-Butyl)-2-(3-nitrophenyl)-4H-3,1-benzoxazine-4-carboxamide

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

N-(n-Butyl)-2-(3-nitrophenyl)-4H-3,1-benzoxazine-4-carboxamide
SpectraBase Compound ID HLBKX6WpX6B
InChI InChI=1S/C19H19N3O4/c1-2-3-11-20-18(23)17-15-9-4-5-10-16(15)21-19(26-17)13-7-6-8-14(12-13)22(24)25/h4-10,12,17H,2-3,11H2,1H3,(H,20,23)
InChIKey PRLZTCCMQKYNJM-UHFFFAOYSA-N
Mol Weight 353.38 g/mol
Molecular Formula C19H19N3O4
Exact Mass 353.137556 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3RvlvL2MTHU
Name N-(N-Butyl)-2-(3-nitrophenyl)-4H-3,1-benzoxazine-4-carboxamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.137556100 u
Formula C19H19N3O4
InChI InChI=1S/C19H19N3O4/c1-2-3-11-20-18(23)17-15-9-4-5-10-16(15)21-19(26-17)13-7-6-8-14(12-13)22(24)25/h4-10,12,17H,2-3,11H2,1H3,(H,20,23)
InChIKey PRLZTCCMQKYNJM-UHFFFAOYSA-N
Molecular Weight 353.378 g/mol
SMILES C1(=NC2=CC=CC=C2C(O1)C(=O)NCCCC)C=1C=C(N(=O)=O)C=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.946053