| SpectraBase Spectrum ID |
LITqN3OPq9E |
| Name |
(10S)-6,7-bis(methylsulfanyl)-10-pentyl-oxecan-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H30O2S2 |
| InChI |
InChI=1S/C16H30O2S2/c1-4-5-6-8-13-11-12-15(20-3)14(19-2)9-7-10-16(17)18-13/h13-15H,4-12H2,1-3H3/t13-,14?,15?/m0/s1 |
| InChIKey |
YBCUPZQDSOPRDI-NFOMZHRRSA-N |
| Instrument Name |
Thermo Scientific TRACE 1310- ISQ LT |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.8b00632 |
| Molecular Weight |
318.534 g/mol |
| SMILES |
C1(O[C@](CCC(C(CCC1)SC)SC)(CCCCC)[H])=O |
| SPLASH |
splash10-072c-9500000000-469ca4d3d1370dde2799 |
| Source of Spectrum |
G4-81-2268-Figure 2-D |
| Wiley ID |
1870174 |
