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2-Decyl-3-methyl-1,4-naphthoquinone
SpectraBase Compound ID 2g6Gt3qONeS
InChI InChI=1S/C21H28O2/c1-3-4-5-6-7-8-9-10-13-17-16(2)20(22)18-14-11-12-15-19(18)21(17)23/h11-12,14-15H,3-10,13H2,1-2H3
InChIKey JZCYOZPRLAGWSS-UHFFFAOYSA-N
Mol Weight 312.45 g/mol
Molecular Formula C21H28O2
Exact Mass 312.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dcRpYWFI03
Name 2-Decyl-3-methyl-1,4-naphthoquinone
CAS Registry Number 117157-41-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O2
InChI InChI=1S/C21H28O2/c1-3-4-5-6-7-8-9-10-13-17-16(2)20(22)18-14-11-12-15-19(18)21(17)23/h11-12,14-15H,3-10,13H2,1-2H3
InChIKey JZCYOZPRLAGWSS-UHFFFAOYSA-N
Molecular Weight 312.453 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)cccc2)CCCCCCCCCC)C
SPLASH splash10-01p9-0907000000-287e59867068074a6e8d
Source of Spectrum KC-1988-561-0
Synonyms 2-decyl-3-methylnaphthalene-1,4-dione
Wiley ID 1313895