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12-DIDEUTERIO-METHYL-OCTADECANOATE
SpectraBase Compound ID 10K2KJVQjTb
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/i8D2
InChIKey HPEUJPJOZXNMSJ-MGVXTIMCSA-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 GDDC60RJbC2
Name Methyl 12,12-dideuteriooctadecanoate
CAS Registry Number 19905-66-9
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/i8D2
InChIKey HPEUJPJOZXNMSJ-MGVXTIMCSA-N
Molecular Weight 300.523 g/mol
SMILES C(=O)(OC)CCCCCCCCCCC(CCCCCC)([2D])[2D]
SPLASH splash10-00dr-9110000000-7fb0f298b3a78d89f52f
Source of Spectrum A-2-125-1
Wiley ID 1301392