SpectraBase Spectrum ID |
5Y6UuTEhVZY |
Name |
(2S)-1-Hydroxy-3-(octanoyloxy)-2-propanyl decanoate |
CAS Registry Number |
177717-46-3 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
372.287574383 u |
Formula |
C21H40O5 |
InChI |
InChI=1S/C21H40O5/c1-3-5-7-9-10-12-14-16-21(24)26-19(17-22)18-25-20(23)15-13-11-8-6-4-2/h19,22H,3-18H2,1-2H3/t19-/m0/s1 |
InChIKey |
YOYOQXRPUDEPAK-IBGZPJMESA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
372.546 g/mol |
Nominal Mass |
372 u |
Quality |
953 |
Retention Index |
2606 |
SMILES |
OC[C@](OC(CCCCCCCCC)=O)(COC(CCCCCCC)=O)[H] |
SPLASH |
splash10-0a4i-9510000000-2f0b17f97355ef311529 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(2S)-1-hydroxy-3-(octanoyloxy)propan-2-yl decanoate |
Technique |
GC/MS |
Wiley ID |
DD2024_021656 |