SpectraBase Spectrum ID |
HWWvVYxXT1Q |
Name |
2-Thioxo-1,3-thiazepan-4-one |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C5H7NOS2 |
InChI |
InChI=1S/C5H7NOS2/c7-4-2-1-3-9-5(8)6-4/h1-3H2,(H,6,7,8) |
InChIKey |
OPBRPERBSVTDHE-UHFFFAOYSA-N |
Molecular Weight |
161.237 g/mol |
SMILES |
N1C(CCCSC1=S)=O |
SPLASH |
splash10-0ik9-0900000000-6bd0c03e4991dd14bc4b |
Source of Spectrum |
Y-36-1173-6 |
Synonyms |
2-sulfanylidene-1,3-thiazepan-4-one |
Wiley ID |
762438 |