SpectraBase Spectrum ID |
HjASp2US0Il |
Name |
2-methyl-3-methylol-thiochromen-4-one |
CAS Registry Number |
29080-55-5 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H10O2S |
InChI |
InChI=1S/C11H10O2S/c1-7-9(6-12)11(13)8-4-2-3-5-10(8)14-7/h2-5,12H,6H2,1H3 |
InChIKey |
CRMJVVWCJTZHCH-UHFFFAOYSA-N |
Molecular Weight |
206.259 g/mol |
SMILES |
OCC=1C(=O)c2c(cccc2)SC1C |
SPLASH |
splash10-0a4r-0960000000-8ca4ebb31d83f5962973 |
Source of Spectrum |
AJ-57-2324-3 |
Synonyms |
3-(hydroxymethyl)-2-methyl-1-benzothiopyran-4-one
3-(hydroxymethyl)-2-methyl-thiochromen-4-one |
Wiley ID |
1204149 |