| SpectraBase Spectrum ID |
4EDCCoghnuy |
| Name |
Cyclohepta[c]pyrrole, 2,4,5,6,7,8-hexahydro-1-(methylthio)-3-phenyl- |
| Alternate Name(s) |
1-(methylsulfanyl)-3-phenyl-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrrole
2-(methylthio)-8-phenyl-4,5,6,7-tetrahydro-3hcyclohepta[c]pyrrole
methyl 3-phenyl-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrrol-1-yl sulfide |
| CAS Registry Number |
132059-03-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19NS |
| InChI |
InChI=1S/C16H19NS/c1-18-16-14-11-7-3-6-10-13(14)15(17-16)12-8-4-2-5-9-12/h2,4-5,8-9,17H,3,6-7,10-11H2,1H3 |
| InChIKey |
LYNLGKIIHGCWCJ-UHFFFAOYSA-N |
| Molecular Weight |
257.395 g/mol |
| SMILES |
[nH]1c(c2CCCCCc2c1-c1ccccc1)SC |
| SPLASH |
splash10-0a4i-0090000000-354a11e6716d1b6d1d06 |
| Source of Spectrum |
F-46-6780-13 |
| Wiley ID |
1260982 |
![Cyclohepta[c]pyrrole, 2,4,5,6,7,8-hexahydro-1-(methylthio)-3-phenyl-](/api/spectrum/4EDCCoghnuy/structure.png?h=300&w=458 "Cyclohepta[c]pyrrole, 2,4,5,6,7,8-hexahydro-1-(methylthio)-3-phenyl-")
