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

*Links on SpectraBase are not permalinks.
3-bromobenzyl (5-amino-1H-tetraazol-1-yl)acetate
SpectraBase Compound ID EBp7swbVxLS
InChI InChI=1S/C10H10BrN5O2/c11-8-3-1-2-7(4-8)6-18-9(17)5-16-10(12)13-14-15-16/h1-4H,5-6H2,(H2,12,13,15)
InChIKey VIJUDDFYNYYMPQ-UHFFFAOYSA-N
Mol Weight 312.13 g/mol
Molecular Formula C10H10BrN5O2
Exact Mass 311.001788 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 1RelPoIIaX
Name (5-Amino-tetrazol-1-yl)-acetic acid 3-bromo-benzyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10BrN5O2
InChI InChI=1S/C10H10BrN5O2/c11-8-3-1-2-7(4-8)6-18-9(17)5-16-10(12)13-14-15-16/h1-4H,5-6H2,(H2,12,13,15)
InChIKey VIJUDDFYNYYMPQ-UHFFFAOYSA-N
Molecular Weight 312.127 g/mol
SMILES Nc1[n](nnn1)CC(=O)OCc1cc(Br)ccc1
SPLASH splash10-00xu-7900000000-15322450484227412168
Synonyms (3-bromophenyl)methyl 2-(5-aminotetrazol-1-yl)acetate (3-bromophenyl)methyl 2-(5-azanyl-1,2,3,4-tetrazol-1-yl)ethanoate 2-(5-amino-1-tetrazolyl)acetic acid (3-bromophenyl)methyl ester 2-(5-aminotetrazol-1-yl)acetic acid (3-bromobenzyl) ester 3-Bromobenzyl (5-amino-1H-tetraazol-1-yl)acetate
Wiley ID 1463611