| SpectraBase Spectrum ID |
1c9jWxIvqA1 |
| Name |
3-(Methylthio)guaiazulene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20S |
| InChI |
InChI=1S/C16H20S/c1-10(2)13-7-6-11(3)16-14(9-13)12(4)8-15(16)17-5/h6-10H,1-5H3 |
| InChIKey |
YHINHHCTSUGNRS-UHFFFAOYSA-N |
| Molecular Weight |
244.396 g/mol |
| SMILES |
c12c(c(SC)cc2C)c(ccc(c1)C(C)C)C |
| SPLASH |
splash10-002f-0090000000-ec1742f4617e509fc568 |
| Source of Spectrum |
AJ-69-2004-20 |
| Synonyms |
5-isopropyl-3,8-dimethyl-1-azulenyl methyl sulfide
7-isopropyl-1,4-dimethyl-3-(methylsulfanyl)azulene |
| Wiley ID |
773664 |
