| SpectraBase Spectrum ID |
Hc6m4xO2x1P |
| Name |
3-Hydroxy-1-(methylthio)-5,6,7,8,9,10,11,12,13,14-decahydrobenzododecene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H26OS |
| InChI |
InChI=1S/C17H26OS/c1-19-17-13-15(18)12-14-10-8-6-4-2-3-5-7-9-11-16(14)17/h12-13,18H,2-11H2,1H3 |
| InChIKey |
PCLCZPWPECXSIT-UHFFFAOYSA-N |
| Molecular Weight |
278.454 g/mol |
| SMILES |
Oc1cc2c(c(c1)SC)CCCCCCCCCC2 |
| SPLASH |
splash10-004i-0090000000-e1c6dde553c3c22c4618 |
| Source of Spectrum |
J-67-5401-4 |
| Synonyms |
4-(methylthio)-5,6,7,8,9,10,11,12,13,14-decahydrobenzo[12]annulen-2-ol
4-methylsulfanyl-5,6,7,8,9,10,11,12,13,14-decahydrobenzo[12]annulen-2-ol |
| Wiley ID |
1570421 |
