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2H-1-benzopyran-2-one, 3-[4-(1-ethyldecyl)phenyl]-7-nitro-
SpectraBase Compound ID 6KUgEFZwumv
InChI InChI=1S/C27H33NO4/c1-3-5-6-7-8-9-10-11-20(4-2)21-12-14-22(15-13-21)25-18-23-16-17-24(28(30)31)19-26(23)32-27(25)29/h12-20H,3-11H2,1-2H3
InChIKey BZNZLMBZTNZBNZ-UHFFFAOYSA-N
Mol Weight 435.6 g/mol
Molecular Formula C27H33NO4
Exact Mass 435.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fpeCFTpy9z
Name 2H-1-benzopyran-2-one, 3-[4-(1-ethyldecyl)phenyl]-7-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H33NO4
InChI InChI=1S/C27H33NO4/c1-3-5-6-7-8-9-10-11-20(4-2)21-12-14-22(15-13-21)25-18-23-16-17-24(28(30)31)19-26(23)32-27(25)29/h12-20H,3-11H2,1-2H3
InChIKey BZNZLMBZTNZBNZ-UHFFFAOYSA-N
Molecular Weight 435.564 g/mol
SMILES CCCCCCCCCC(CC)c1ccc(cc1)C1=Cc2ccc(cc2OC1=O)[N+]([O-])=O
SPLASH splash10-0a5i-4384900000-4cb9697def38d802af69
Source of Spectrum JX-2015-4-432
Synonyms 3-(4-(dodecan-3-yl)phenyl)-7-nitro-2H-chromen-2-one 3-[4-(dodecan-3-yl)phenyl]-7-nitro-2H-chromen-2-one 3-(4-dodecan-3-ylphenyl)-7-nitro-1-benzopyran-2-one 3-(4-dodecan-3-ylphenyl)-7-nitrochromen-2-one 3-[4-(1-ethyldecyl)phenyl]-7-nitro-chromen-2-one 3-(4-dodecan-3-ylphenyl)-7-nitro-chromen-2-one
Wiley ID 1725872