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2-DIDEUTERIO-METHYL-OCTADECANOATE
SpectraBase Compound ID CzAiYrKmgd4
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/i18D2
InChIKey HPEUJPJOZXNMSJ-CPLZMPMBSA-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 8N2D2pGAghS
Name Octadecanoic-2,2-D2 acid, methyl ester
Alternate Name(s) Stearic-2,2-D2 acid, methyl ester Methyl 2,2-dideuteriooctadecanoate Methyl stearate-2,2-D2
CAS Registry Number 19905-59-0
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/i18D2
InChIKey HPEUJPJOZXNMSJ-CPLZMPMBSA-N
Molecular Weight 300.523 g/mol
SMILES C(=O)(OC)C(CCCCCCCCCCCCCCCC)([2D])[2D]
SPLASH splash10-004r-9121000000-0f3e841bf42fda2fb826
Source of Spectrum T-68-4309-0
Wiley ID 77410