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Methyl 11,12-dideutero octadecanoate

View entire compound with spectra: 2 MS (GC)

Methyl 11,12-dideutero octadecanoate
SpectraBase Compound ID H3kDoh2slxn
InChI InChI=1S/C19H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h3-18H2,1-2H3/i8D,9D
InChIKey HPEUJPJOZXNMSJ-XETGXLELSA-N
Mol Weight 300.5 g/mol
Molecular Formula C19H362D2O2
Exact Mass 300.299734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOSUZsVubaB
Name Methyl 11,12-dideutero octadecanoate
CAS Registry Number 54934-62-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36D2O2
InChI InChI=1S/C19H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h3-18H2,1-2H3/i8D,9D
InChIKey HPEUJPJOZXNMSJ-XETGXLELSA-N
Molecular Weight 300.523 g/mol
SMILES C(=O)(OC)CCCCCCCCCC(C(CCCCCC)[2D])[2D]
SPLASH splash10-00du-9000000000-8872167fc612b7675f3f
Source of Spectrum T-68-4331-0
Wiley ID 44242