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2,5-Cyclohexadiene-1,4-dione, 2,5-dichloro-3,6-bis(octylamino)-
SpectraBase Compound ID 1as0ODzi4p9
InChI InChI=1S/C22H36Cl2N2O2/c1-3-5-7-9-11-13-15-25-19-17(23)22(28)20(18(24)21(19)27)26-16-14-12-10-8-6-4-2/h25-26H,3-16H2,1-2H3
InChIKey PYPFVAVEAYPINP-UHFFFAOYSA-N
Mol Weight 431.4 g/mol
Molecular Formula C22H36Cl2N2O2
Exact Mass 430.215384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4epjRxpE1I
Name 2,5-Cyclohexadiene-1,4-dione, 2,5-dichloro-3,6-bis(octylamino)-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36Cl2N2O2
InChI InChI=1S/C22H36Cl2N2O2/c1-3-5-7-9-11-13-15-25-19-17(23)22(28)20(18(24)21(19)27)26-16-14-12-10-8-6-4-2/h25-26H,3-16H2,1-2H3
InChIKey PYPFVAVEAYPINP-UHFFFAOYSA-N
Molecular Weight 431.448 g/mol
SMILES N(CCCCCCCC)C1=C(C(C(=C(C1=O)Cl)NCCCCCCCC)=O)Cl
SPLASH splash10-00lr-8249600000-ff9a0eefe7a15b3c9147
Source of Spectrum JX-2015-4-394
Synonyms 2,5-Dichloro-3,6-bis(octylamino)cyclohexa-2,5-diene-1,4-dione 2,5-Dichloro-3,6-bis(octylamino)-1,4-benzoquinone 2,5-Bis(chloranyl)-3,6-bis(octylamino)cyclohexa-2,5-diene-1,4-dione
Wiley ID 1725836