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

*Links on SpectraBase are not permalinks.

3-NITRO-4-(PHENYLTHIO)BENZALDEHYDE

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

3-NITRO-4-(PHENYLTHIO)BENZALDEHYDE
SpectraBase Compound ID COK4Vt4rfED
InChI InChI=1S/C13H9NO3S/c15-9-10-6-7-13(12(8-10)14(16)17)18-11-4-2-1-3-5-11/h1-9H
InChIKey ATBVFIKZUSBTDE-UHFFFAOYSA-N
Mol Weight 259.28 g/mol
Molecular Formula C13H9NO3S
Exact Mass 259.030314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 2TQ1B47VkDW
Name 3-Nitro-4-(phenylsulfanyl)benzaldehyde
CAS Registry Number 69054-34-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9NO3S
InChI InChI=1S/C13H9NO3S/c15-9-10-6-7-13(12(8-10)14(16)17)18-11-4-2-1-3-5-11/h1-9H
InChIKey ATBVFIKZUSBTDE-UHFFFAOYSA-N
Molecular Weight 259.279 g/mol
SMILES c1ccc(Sc2c(N(=O)=O)cc(C=O)cc2)cc1
SPLASH splash10-014l-1910000000-c7d468fa52306fe7ccd6
Synonyms 3-Nitro-4-(phenylthio)benzaldehyde Benzaldehyde, 3-nitro-4-phenylthio- 3-Nitro-4-phenylsulfanylbenzaldehyde
Wiley ID 1455566