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

*Links on SpectraBase are not permalinks.
5-(bromomethyl)-6-methyl-2,1,3-benzothiadiazol
SpectraBase Compound ID IYVY5hpQ1rJ
InChI InChI=1S/C8H7BrN2S/c1-5-2-7-8(11-12-10-7)3-6(5)4-9/h2-3H,4H2,1H3
InChIKey OTNOBYPMTJZXCM-UHFFFAOYSA-N
Mol Weight 243.12 g/mol
Molecular Formula C8H7BrN2S
Exact Mass 241.951332 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 H7TafrTuMyR
Name 5-(bromomethyl)-6-methyl-2,1,3-benzothiadiazol
CAS Registry Number 109123-53-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7BrN2S
InChI InChI=1S/C8H7BrN2S/c1-5-2-7-8(11-12-10-7)3-6(5)4-9/h2-3H,4H2,1H3
InChIKey OTNOBYPMTJZXCM-UHFFFAOYSA-N
Molecular Weight 243.122 g/mol
SMILES c12c(cc(c(c2)CBr)C)nsn1
SPLASH splash10-03di-0920000000-0c16b7e8f6e17c416856
Source of Spectrum K-120-1594-4
Synonyms 5-(bromomethyl)-6-methyl-2,1,3-benzothiadiazole
Wiley ID 1244481