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Phytenic acid

View entire compound with spectra: 1 MS (GC)

Phytenic acid
SpectraBase Compound ID IIsOkziQjYa
InChI InChI=1S/C20H38O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)15-20(21)22/h15-18H,6-14H2,1-5H3,(H,21,22)
InChIKey WDWBNNBRPVEEOD-UHFFFAOYSA-N
Mol Weight 310.5 g/mol
Molecular Formula C20H38O2
Exact Mass 310.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0vOJKBT1gI
Name Phytenic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O2
InChI InChI=1S/C20H38O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)15-20(21)22/h15-18H,6-14H2,1-5H3,(H,21,22)
InChIKey WDWBNNBRPVEEOD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200000152
Molecular Weight 310.522 g/mol
SMILES OC(C=C(C)CCCC(C)CCCC(C)CCCC(C)C)=O
SPLASH splash10-0fb9-0920000000-27557c80cabab0bf53a7
Source of Spectrum QA-47-1135-16
Synonyms 3,7,11,15-tetramethylhexadec-2-enoic acid
Wiley ID 1795153