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

*Links on SpectraBase are not permalinks.
1-Benzyl 4-Methyl 2-[(p-bromobenzenesulfonyl)amino]-5-amino-terephthalate
SpectraBase Compound ID 9DHJntbCgen
InChI InChI=1S/C22H19BrN2O6S/c1-30-21(26)17-12-20(25-32(28,29)16-9-7-15(23)8-10-16)18(11-19(17)24)22(27)31-13-14-5-3-2-4-6-14/h2-12,25H,13,24H2,1H3
InChIKey OBTZXQIDOIPTJY-UHFFFAOYSA-N
Mol Weight 519.37 g/mol
Molecular Formula C22H19BrN2O6S
Exact Mass 518.014721 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 cFMoAVSM6W
Name 1-Benzyl 4-Methyl 2-[(p-bromobenzenesulfonyl)amino]-5-amino-terephthalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19BrN2O6S
InChI InChI=1S/C22H19BrN2O6S/c1-30-21(26)17-12-20(25-32(28,29)16-9-7-15(23)8-10-16)18(11-19(17)24)22(27)31-13-14-5-3-2-4-6-14/h2-12,25H,13,24H2,1H3
InChIKey OBTZXQIDOIPTJY-UHFFFAOYSA-N
Molecular Weight 519.366 g/mol
SMILES N(c1cc(c(cc1C(OCc1ccccc1)=O)N)C(=O)OC)S(c1ccc(cc1)Br)(=O)=O
SPLASH splash10-0006-9030020000-cafcfafe5abdd925bfef
Source of Spectrum QE-15-2205-9b
Wiley ID 1692686