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

*Links on SpectraBase are not permalinks.
2-(1-benzotriazolyl)-1-(4-nitrophenyl)-2-triphenylphosphoranylideneethanone
SpectraBase Compound ID 5KQO4zuOlSk
InChI InChI=1S/C32H23N4O3P/c37-31(24-20-22-25(23-21-24)36(38)39)32(35-30-19-11-10-18-29(30)33-34-35)40(26-12-4-1-5-13-26,27-14-6-2-7-15-27)28-16-8-3-9-17-28/h1-23H
InChIKey JOFASWVMHINHCS-UHFFFAOYSA-N
Mol Weight 542.5 g/mol
Molecular Formula C32H23N4O3P
Exact Mass 542.150778 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 4h4RCIyj83V
Name 2-(1-benzotriazolyl)-1-(4-nitrophenyl)-2-triphenylphosphoranylideneethanone
Alternate Name(s) 2-(benzotriazol-1-yl)-1-(4-nitrophenyl)-2-triphenylphosphoranylidene-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H23N4O3P
InChI InChI=1S/C32H23N4O3P/c37-31(24-20-22-25(23-21-24)36(38)39)32(35-30-19-11-10-18-29(30)33-34-35)40(26-12-4-1-5-13-26,27-14-6-2-7-15-27)28-16-8-3-9-17-28/h1-23H
InChIKey JOFASWVMHINHCS-UHFFFAOYSA-N
Molecular Weight 542.535 g/mol
SMILES C([n]1nnc2c1cccc2)(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-08gi-0980000000-9f1d4e38f40aa3e7d8af
Source of Spectrum KC-0-3110-2
Wiley ID 823687