SpectraBase Spectrum ID |
JF96r2WK728 |
Name |
(2S)-1-(Acetyloxy)-3-(octanoyloxy)propan-2-yl octanoate |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
386.266838938 u |
Formula |
C21H38O6 |
InChI |
InChI=1S/C21H38O6/c1-4-6-8-10-12-14-20(23)26-17-19(16-25-18(3)22)27-21(24)15-13-11-9-7-5-2/h19H,4-17H2,1-3H3/t19-/m0/s1 |
InChIKey |
JTPWKHMDSHSVHB-IBGZPJMESA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
386.529 g/mol |
Nominal Mass |
386 u |
Quality |
994 |
Retention Index |
2702 |
SMILES |
[C@](OC(CCCCCCC)=O)(COC(CCCCCCC)=O)(COC(=O)C)[H] |
SPLASH |
splash10-0a6u-9510000000-b65c1f9cb562ddb6e9ca |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(2S)-1-(acetyloxy)-3-(octanoyloxy)propan-2-yl octanoate |
Technique |
GC/MS |
Wiley ID |
DD2024_033165 |