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

*Links on SpectraBase are not permalinks.
O,O-Diphenyl-2-t-butylthio-1-(N-phenylthioureido)ethanephosphonate
SpectraBase Compound ID IxEA29qrXiS
InChI InChI=1S/C25H29N2O3PS2/c1-25(2,3)33-19-23(27-24(32)26-20-13-7-4-8-14-20)31(28,29-21-15-9-5-10-16-21)30-22-17-11-6-12-18-22/h4-18,23H,19H2,1-3H3,(H2,26,27,32)
InChIKey HPZZBHKWHWZBSS-UHFFFAOYSA-N
Mol Weight 500.61 g/mol
Molecular Formula C25H29N2O3PS2
Exact Mass 500.135722 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 4Nb0fBFo2a
Name O,O-Diphenyl-2-t-butylthio-1-(N-phenylthioureido)ethanephosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29N2O3PS2
InChI InChI=1S/C25H29N2O3PS2/c1-25(2,3)33-19-23(27-24(32)26-20-13-7-4-8-14-20)31(28,29-21-15-9-5-10-16-21)30-22-17-11-6-12-18-22/h4-18,23H,19H2,1-3H3,(H2,26,27,32)
InChIKey HPZZBHKWHWZBSS-UHFFFAOYSA-N
Molecular Weight 500.612 g/mol
SMILES N(C(P(Oc1ccccc1)(Oc1ccccc1)=O)CSC(C)(C)C)C(Nc1ccccc1)=S
SPLASH splash10-0f6x-9008100000-18181e516864f90e5455
Source of Spectrum SO-0-644-8
Synonyms diphenyl 1-[(anilinocarbothioyl)amino]-2-(tert-butylsulfanyl)ethylphosphonate
Wiley ID 1537618