SpectraBase Spectrum ID |
9xLSNtQz4wC |
Name |
Mentha-8-thiol-3-one |
CAS Registry Number |
35117-85-2 |
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 |
GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
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-YUMQZZPRSA-N |
Molecular Weight |
186.313 g/mol |
Nominal Mass |
186 u |
Number of Peaks |
98 |
SMILES |
SC(C)(C)[C@]1(CC[C@](C)(CC1=O)[H])[H] |
SPLASH |
splash10-066u-9200000000-3ac3676cfc5ebb4d991a |
Source |
ex ALDRICH |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA000902 |