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Methyl-6,6-dideuterioheptadecanoate
SpectraBase Compound ID KwMPo6zv11B
InChI InChI=1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h3-17H2,1-2H3/i13D2
InChIKey HUEBIMLTDXKIPR-KLTYLHELSA-N
Mol Weight 286.5 g/mol
Molecular Formula C18H342D2O2
Exact Mass 286.284084 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KK1IW7btotq
Name Methyl-6,6-dideuterioheptadecanoate
CAS Registry Number 29800-75-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H34D2O2
InChI InChI=1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h3-17H2,1-2H3/i13D2
InChIKey HUEBIMLTDXKIPR-KLTYLHELSA-N
Molecular Weight 286.496 g/mol
SMILES C(=O)(OC)CCCCC(CCCCCCCCCCC)([2D])[2D]
SPLASH splash10-007c-9110000000-9048d0c35bda61c603e8
Source of Spectrum T-68-4105-0
Wiley ID 41755