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

*Links on SpectraBase are not permalinks.
Methyl 4-[4'-(phenylmethyl)-1',1',3'-trioxo-1'-.lambda( 6).,2,5-thiadiazolan-2'-yl]-benzoate
SpectraBase Compound ID DC9O1JAHVsT
InChI InChI=1S/C17H16N2O5S/c1-24-17(21)13-7-9-14(10-8-13)19-16(20)15(18-25(19,22)23)11-12-5-3-2-4-6-12/h2-10,15,18H,11H2,1H3
InChIKey PSVDGIBEKUXWAA-UHFFFAOYSA-N
Mol Weight 360.38 g/mol
Molecular Formula C17H16N2O5S
Exact Mass 360.077993 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 35ESzMdwY2v
Name Methyl 4-[4'-(phenylmethyl)-1',1',3'-trioxo-1'-.lambda( 6).,2,5-thiadiazolan-2'-yl]-benzoate
Alternate Name(s) Methyl 4-(4-benzyl-1,1-dioxido-3-oxo-1,2,5-thiadiazolidin-2-yl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O5S
InChI InChI=1S/C17H16N2O5S/c1-24-17(21)13-7-9-14(10-8-13)19-16(20)15(18-25(19,22)23)11-12-5-3-2-4-6-12/h2-10,15,18H,11H2,1H3
InChIKey PSVDGIBEKUXWAA-UHFFFAOYSA-N
Molecular Weight 360.384 g/mol
SMILES N1C(C(N(S1(=O)=O)c1ccc(C(=O)OC)cc1)=O)Cc1ccccc1
SPLASH splash10-0fk9-2900000000-86957c36a60ee6b52074
Source of Spectrum H-82-2441-7
Wiley ID 815749