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Octan-2-yl palmitate
SpectraBase Compound ID 4Y3y4q5Zq6k
InChI InChI=1S/C24H48O2/c1-4-6-8-10-11-12-13-14-15-16-17-18-20-22-24(25)26-23(3)21-19-9-7-5-2/h23H,4-22H2,1-3H3
InChIKey CHGJJXYCZVFOGE-UHFFFAOYSA-N
Mol Weight 368.6 g/mol
Molecular Formula C24H48O2
Exact Mass 368.365431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8In9ZQWr2q8
Name Octan-2-yl palmitate
CAS Registry Number 55194-81-5
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 368.365430784 u
Formula C24H48O2
InChI InChI=1S/C24H48O2/c1-4-6-8-10-11-12-13-14-15-16-17-18-20-22-24(25)26-23(3)21-19-9-7-5-2/h23H,4-22H2,1-3H3
InChIKey CHGJJXYCZVFOGE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 368.646 g/mol
Nominal Mass 368 u
Quality 968
Retention Index 2592
SMILES C(OC(CCCCCC)C)(CCCCCCCCCCCCCCC)=O
SPLASH splash10-0c00-9320000000-022c01806d7e3e491367
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Octan-2-yl hexadecanoate
Technique GC/MS
Wiley ID DD2024_029609