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3-HYDROXYIRISQUINONE;3-[(Z)-10-HEPTADECENYL]-2-HYDROXY-5-METHOXY-PARA-BENZOQUINONE
SpectraBase Compound ID JJjMgfaGWYY
InChI InChI=1S/C24H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)21(25)19-22(28-2)24(20)27/h8-9,19,26H,3-7,10-18H2,1-2H3/b9-8-
InChIKey GCSKCOTXJCWJBF-HJWRWDBZSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dLrXNhaLjR
Name 5-Hydroxyirisquinone
Alternate Name(s) 3-[(10Z)-10-heptadecenyl]-2-hydroxy-5-methoxybenzo-1,4-quinone 3-[10'-Heptadecenyl]-2-hydroxy-5-methoxy-1,4-benzoquinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)21(25)19-22(28-2)24(20)27/h8-9,19,26H,3-7,10-18H2,1-2H3/b9-8-
InChIKey GCSKCOTXJCWJBF-HJWRWDBZSA-N
Molecular Weight 390.564 g/mol
SMILES OC1=C(C(C(=CC1=O)OC)=O)CCCCCCCCC\C=C/CCCCCC
SPLASH splash10-0006-0209000000-66c16059cb3ee3e3b34d
Source of Spectrum U-1995-137-5
Wiley ID 766337