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Octanoic acid, 2,4,6-trimethyl-, methyl ester
SpectraBase Compound ID KA2Jdi8P9Nd
InChI InChI=1S/C12H24O2/c1-6-9(2)7-10(3)8-11(4)12(13)14-5/h9-11H,6-8H2,1-5H3
InChIKey RBRLRKACDFDWRL-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcBgAWZliRT
Name Octanoic acid, 2,4,6-trimethyl-, methyl ester
CAS Registry Number 54984-07-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-6-9(2)7-10(3)8-11(4)12(13)14-5/h9-11H,6-8H2,1-5H3
InChIKey RBRLRKACDFDWRL-UHFFFAOYSA-N
Molecular Weight 200.322 g/mol
SMILES C(C(CC(CC)C)C)C(C(OC)=O)C
SPLASH splash10-0f79-9300000000-c21b2a105893dd5e01c8
Source of Spectrum AA-0-1417-3
Synonyms Methyl 2,4,6-trimethyloctanoate 2,4,6-trimethylcaprylic acid methyl ester 2,4,6-trimethyloctanoic acid methyl ester
Wiley ID 23492