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2-(3-Methylbut-2-enyl)-3-[(phenylmethyl)amino]naphthalene-1,4-dione
SpectraBase Compound ID 4dKo1B6xodP
InChI InChI=1S/C22H21NO2/c1-15(2)12-13-19-20(23-14-16-8-4-3-5-9-16)22(25)18-11-7-6-10-17(18)21(19)24/h3-12,23H,13-14H2,1-2H3
InChIKey QHMQKWHYAUCXOB-UHFFFAOYSA-N
Mol Weight 331.42 g/mol
Molecular Formula C22H21NO2
Exact Mass 331.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41oYvQ6JH1R
Name 2-(3-Methylbut-2-enyl)-3-[(phenylmethyl)amino]naphthalene-1,4-dione
Alternate Name(s) 2-(benzylamino)-3-(3-methylbut-2-enyl)-1,4-naphthoquinone 2-(benzylamino)-3-(3-methylbut-2-enyl)naphthalene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO2
InChI InChI=1S/C22H21NO2/c1-15(2)12-13-19-20(23-14-16-8-4-3-5-9-16)22(25)18-11-7-6-10-17(18)21(19)24/h3-12,23H,13-14H2,1-2H3
InChIKey QHMQKWHYAUCXOB-UHFFFAOYSA-N
Molecular Weight 331.415 g/mol
SMILES N(C=1C(c2c(C(C1CC=C(C)C)=O)cccc2)=O)Cc1ccccc1
SPLASH splash10-004i-1090000000-306ae4080938969a9abc
Source of Spectrum F-57-9573-3
Wiley ID 1626481