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(2S)-1-Hydroxy-3-(octanoyloxy)-2-propanyl decanoate
SpectraBase Compound ID C1GPJoVFH9o
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
Mol Weight 372.5 g/mol
Molecular Formula C21H40O5
Exact Mass 372.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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