| SpectraBase Spectrum ID |
IEqLZnfSIZD |
| Name |
Menthan-3-one <8-mercapto-, cis-, para-> |
| CAS Registry Number |
33284-96-7 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
186.107836373 u |
| Formula |
C10H18OS |
| InChI |
InChI=1S/C10H18OS/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-8,12H,4-6H2,1-3H3/t7-,8+/m0/s1 |
| InChIKey |
RVOKNSFEAOYULQ-JGVFFNPUSA-N |
| Molecular Weight |
186.313 g/mol |
| Number of Peaks |
50 |
| RI1 |
1377 |
| RI2 |
1056 |
| SMILES |
SC([C@]1(C(C[C@](CC1)(C)[H])=O)[H])(C)C |
| SPLASH |
splash10-066u-9300000000-6b30d29af9613b912f02 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2R,5S)- |
| Wiley ID |
LM_FFNSC3_1182 |
