SpectraBase Spectrum ID |
yi1f2fdQoX |
Name |
2-Bromomethyl-2H-[1,4]benzothiazin-3(4H)-one |
CAS Registry Number |
139565-00-7 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C9H8BrNOS |
InChI |
InChI=1S/C9H8BrNOS/c10-5-8-9(12)11-6-3-1-2-4-7(6)13-8/h1-4,8H,5H2,(H,11,12) |
InChIKey |
XCIIAXQHUNZGKV-UHFFFAOYSA-N |
Molecular Weight |
258.133 g/mol |
SMILES |
N1c2c(SC(C1=O)CBr)cccc2 |
SPLASH |
splash10-0bt9-0690000000-df1166631c07e8f1077e |
Source of Spectrum |
U-1992-405-6 |
Wiley ID |
764181 |