SpectraBase Spectrum ID |
9M3vbRTIglx |
Name |
Dihydrobenzofuran-2-one, 3-[2-nitrophenyl]methylene- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
267.053157770 u |
Formula |
C15H9NO4 |
InChI |
InChI=1S/C15H9NO4/c17-15-12(11-6-2-4-8-14(11)20-15)9-10-5-1-3-7-13(10)16(18)19/h1-9H/b12-9+ |
InChIKey |
QLGKRGQJWVXDNL-FMIVXFBMSA-N |
Molecular Weight |
267.240 g/mol |
SMILES |
C1(=C(C=CC=C1)N(=O)=O)\C=C/1C=2C=CC=CC2OC1=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.858175 |