| SpectraBase Spectrum ID |
Hl8zSXXXeIZ |
| Name |
methyl 11-methyl-12,13-bis(methylsulfanyl)octadecanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H44O2S2 |
| InChI |
InChI=1S/C22H44O2S2/c1-6-7-13-17-20(25-4)22(26-5)19(2)16-14-11-9-8-10-12-15-18-21(23)24-3/h19-20,22H,6-18H2,1-5H3 |
| InChIKey |
LYJFPPMEWCYARV-UHFFFAOYSA-N |
| Instrument Name |
Agilent GC 7890A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.14.112 |
| Molecular Weight |
404.712 g/mol |
| SMILES |
COC(=O)CCCCCCCCCC(C)C(C(CCCCC)SC)SC |
| SPLASH |
splash10-008c-9530000000-9af344bc3d701d136484 |
| Source of Spectrum |
BJO-14-SM2-Fig. S2 |
| Wiley ID |
1843499 |
