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(9Z,12Z,15Z)-9,10,12,13,15,16-hexadeuterio-1-octadeca-9,12,15-trienol

View entire compound with spectra: 1 MS (GC)

(9Z,12Z,15Z)-9,10,12,13,15,16-hexadeuterio-1-octadeca-9,12,15-trienol
SpectraBase Compound ID 3beFhdOtqNV
InChI InChI=1S/C18H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h3-4,6-7,9-10,19H,2,5,8,11-18H2,1H3/b4-3-,7-6-,10-9-/i3D,4D,6D,7D,9D,10D
InChIKey IKYKEVDKGZYRMQ-CWUBCFKBSA-N
Mol Weight 270.49 g/mol
Molecular Formula C18H262D6O
Exact Mass 270.282976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTPex9sNZSF
Name (9Z,12Z,15Z)-9,10,12,13,15,16-hexadeuterio-1-octadeca-9,12,15-trienol
Alternate Name(s) (9Z,12Z,15Z)-9,10,12,13,15,16-hexadeuteriooctadeca-9,12,15-trien-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26D6O
InChI InChI=1S/C18H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h3-4,6-7,9-10,19H,2,5,8,11-18H2,1H3/b4-3-,7-6-,10-9-/i3D,4D,6D,7D,9D,10D
InChIKey IKYKEVDKGZYRMQ-CWUBCFKBSA-N
Molecular Weight 270.490 g/mol
SMILES OCCCCCCCC\C(=C/(C\C(=C/(C\C(=C/(CC)[2D])[2D])[2D])[2D])[2D])[2D]
SPLASH splash10-001l-9100000000-667f1c3b38479a69dba4
Source of Spectrum KC-0-1851-31
Wiley ID 825543