SpectraBase Spectrum ID |
vInAR9UGQ3 |
Name |
Phenyl (2-(p-nitrobenzoyloxy)ethyl)carbamate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
330.085186173 u |
Formula |
C16H14N2O6 |
InChI |
InChI=1S/C16H14N2O6/c19-15(12-6-8-13(9-7-12)18(21)22)23-11-10-17-16(20)24-14-4-2-1-3-5-14/h1-9H,10-11H2,(H,17,20) |
InChIKey |
PRUYDAMDCBMMKZ-UHFFFAOYSA-N |
Molecular Weight |
330.296 g/mol |
SMILES |
C(NCCOC(=O)C1=CC=C(C=C1)N(=O)=O)(=O)OC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839545 |