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1,4-Naphthalenedione, 2,3-didecyl-
SpectraBase Compound ID 8qPMHvgDJI7
InChI InChI=1S/C30H46O2/c1-3-5-7-9-11-13-15-17-21-25-26(22-18-16-14-12-10-8-6-4-2)30(32)28-24-20-19-23-27(28)29(25)31/h19-20,23-24H,3-18,21-22H2,1-2H3
InChIKey GZMSJDKTNSNBQI-UHFFFAOYSA-N
Mol Weight 438.7 g/mol
Molecular Formula C30H46O2
Exact Mass 438.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cMLvyXm5rQ
Name 1,4-Naphthalenedione, 2,3-didecyl-
Alternate Name(s) 2,3-Didecyl-1,4-naphthoquinone 2,3-Didecylnaphthoquinone
CAS Registry Number 117157-39-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H46O2
InChI InChI=1S/C30H46O2/c1-3-5-7-9-11-13-15-17-21-25-26(22-18-16-14-12-10-8-6-4-2)30(32)28-24-20-19-23-27(28)29(25)31/h19-20,23-24H,3-18,21-22H2,1-2H3
InChIKey GZMSJDKTNSNBQI-UHFFFAOYSA-N
Molecular Weight 438.696 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)cccc2)CCCCCCCCCC)CCCCCCCCCC
SPLASH splash10-000i-0000900000-5944578278acc27498dd
Source of Spectrum KC-1988-560-0
Wiley ID 1384327