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Decanoic acid,dodecyl ester
SpectraBase Compound ID 267wKjhae7X
InChI InChI=1S/C22H44O2/c1-3-5-7-9-11-12-13-15-17-19-21-24-22(23)20-18-16-14-10-8-6-4-2/h3-21H2,1-2H3
InChIKey MNOODXPYABBZMC-UHFFFAOYSA-N
Mol Weight 340.6 g/mol
Molecular Formula C22H44O2
Exact Mass 340.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JRRcw15Mrg
Name Decanoic acid,dodecyl ester
CAS Registry Number 42231-50-5
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 340.334130655 u
Formula C22H44O2
InChI InChI=1S/C22H44O2/c1-3-5-7-9-11-12-13-15-17-19-21-24-22(23)20-18-16-14-10-8-6-4-2/h3-21H2,1-2H3
InChIKey MNOODXPYABBZMC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 340.592 g/mol
Nominal Mass 340 u
Quality 951
Retention Index 2391
SMILES C(OCCCCCCCCCCCC)(CCCCCCCCC)=O
SPLASH splash10-05fu-9500000000-c23bf227a683714b3d7b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms dodecyl decanoate
Technique GC/MS
Wiley ID DD2024_022331