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3,7,11-Trimethyl-dodecanoic acid, methyl ester
SpectraBase Compound ID 3cFA1tbc47C
InChI InChI=1S/C16H32O2/c1-13(2)8-6-9-14(3)10-7-11-15(4)12-16(17)18-5/h13-15H,6-12H2,1-5H3
InChIKey YMFMGLHUWRLVMT-UHFFFAOYSA-N
Mol Weight 256.4 g/mol
Molecular Formula C16H32O2
Exact Mass 256.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 95kdMgIjkO1
Name Dodecanoic acid, 3,7,11-trimethyl-, methyl ester
Alternate Name(s) 3,7,11-trimethyldodecanoic acid methyl ester 3,7,11-trimethyllauric acid methyl ester
CAS Registry Number 1001-08-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H32O2
InChI InChI=1S/C16H32O2/c1-13(2)8-6-9-14(3)10-7-11-15(4)12-16(17)18-5/h13-15H,6-12H2,1-5H3
InChIKey YMFMGLHUWRLVMT-UHFFFAOYSA-N
Molecular Weight 256.430 g/mol
SMILES C(C(CCCC(CCCC(C)C)C)C)C(OC)=O
SPLASH splash10-00di-9100000000-f7496987c1b4aa921708
Source of Spectrum Va-0-0-0
Wiley ID 743586