| SpectraBase Spectrum ID |
BFFG9TB1kHo |
| Name |
2,5,5-Trimethyl-2-(butylthio)cycloheptatriene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H22S |
| InChI |
InChI=1S/C14H22S/c1-5-6-12-15-14(4)9-7-8-13(2,3)10-11-14/h8-11H,5-6,12H2,1-4H3 |
| InChIKey |
PCZSMZQTTWISSH-UHFFFAOYSA-N |
| Molecular Weight |
222.390 g/mol |
| SMILES |
C1=C=CC(C=CC1(SCCCC)C)(C)C |
| SPLASH |
splash10-0a4i-0090000000-7fa10a4406d37bbc97e6 |
| Source of Spectrum |
F-48-6048-7 |
| Wiley ID |
1223023 |
