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(Z)-9-[11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,18-2H17]octadecenoic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(Z)-9-[11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,18-2H17]octadecenoic acid methyl ester
SpectraBase Compound ID K07K9DzCDdG
InChI InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-9,12-18H2,1-2H3/b11-10-/i1D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2
InChIKey QYDYPVFESGNLHU-BGABMKCHSA-N
Mol Weight 313.6 g/mol
Molecular Formula C19H192D17O2
Exact Mass 313.378235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmepNcnPgoe
Name (Z)-9-[11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,18-2H17]octadecenoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19D17O2
InChI InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-9,12-18H2,1-2H3/b11-10-/i1D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2
InChIKey QYDYPVFESGNLHU-BGABMKCHSA-N
Molecular Weight 313.599 g/mol
SMILES C(=O)(OC)CCCCCCC\C=C/C(C(C(C(C(C(C(C([2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D]
SPLASH splash10-06zc-9100000000-1fbefa40f54a88a38c01
Source of Spectrum F-55-963-2
Wiley ID 836557