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1-Amino-4-(cyclohexylamino)-2-(2-hydroxyethylsulfanyl)anthracene-9,10-dione

View entire compound with spectra: 1 MS (GC)

1-Amino-4-(cyclohexylamino)-2-(2-hydroxyethylsulfanyl)anthracene-9,10-dione
SpectraBase Compound ID DFjY5RhUURG
InChI InChI=1S/C22H24N2O3S/c23-20-17(28-11-10-25)12-16(24-13-6-2-1-3-7-13)18-19(20)22(27)15-9-5-4-8-14(15)21(18)26/h4-5,8-9,12-13,24-25H,1-3,6-7,10-11,23H2
InChIKey CBPYVXPFDNCXPY-UHFFFAOYSA-N
Mol Weight 396.51 g/mol
Molecular Formula C22H24N2O3S
Exact Mass 396.150764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMtmLtsI7HL
Name 1-Amino-4-(cyclohexylamino)-2-(2-hydroxyethylsulfanyl)anthracene-9,10-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O3S
InChI InChI=1S/C22H24N2O3S/c23-20-17(28-11-10-25)12-16(24-13-6-2-1-3-7-13)18-19(20)22(27)15-9-5-4-8-14(15)21(18)26/h4-5,8-9,12-13,24-25H,1-3,6-7,10-11,23H2
InChIKey CBPYVXPFDNCXPY-UHFFFAOYSA-N
Molecular Weight 396.505 g/mol
SMILES Nc1c2c(c(cc1SCCO)NC1CCCCC1)C(c1c(C2=O)cccc1)=O
SPLASH splash10-0002-1019000000-5cdb966f9508151ae0d5
Source of Spectrum IC-1100-0-0
Synonyms 1-Amino-4-(cyclohexylamino)-2-(2-hydroxyethylthio)-9,10-anthraquinone 1-Amino-4-(cyclohexylamino)-2-(2-hydroxyethylthio)anthracene-9,10-dione 1-Azanyl-4-(cyclohexylamino)-2-(2-hydroxyethylsulfanyl)anthracene-9,10-dione
Wiley ID 1367456