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Anthracene-9,10-dione, 1,4-bis(octadecylamino)-
SpectraBase Compound ID EAMpVIH6E4f
InChI InChI=1S/C50H82N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-41-51-45-39-40-46(48-47(45)49(53)43-37-33-34-38-44(43)50(48)54)52-42-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-34,37-40,51-52H,3-32,35-36,41-42H2,1-2H3
InChIKey SKSUDYPOYANBDP-UHFFFAOYSA-N
Mol Weight 743.2 g/mol
Molecular Formula C50H82N2O2
Exact Mass 742.63763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnBYr9xtJvD
Name Anthracene-9,10-dione, 1,4-bis(octadecylamino)-
Alternate Name(s) 1,4-Bis(octadecylamino)anthra-9,10-quinone 1,4-bis(octadecylamino)anthracene-9,10-dione 1,4-bis(stearylamino)-9,10-anthraquinone
CAS Registry Number 65177-52-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C50H82N2O2
InChI InChI=1S/C50H82N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-41-51-45-39-40-46(48-47(45)49(53)43-37-33-34-38-44(43)50(48)54)52-42-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-34,37-40,51-52H,3-32,35-36,41-42H2,1-2H3
InChIKey SKSUDYPOYANBDP-UHFFFAOYSA-N
Molecular Weight 743.218 g/mol
SMILES N(c1c2c(c(cc1)NCCCCCCCCCCCCCCCCCC)C(c1c(C2=O)cccc1)=O)CCCCCCCCCCCCCCCCCC
SPLASH splash10-0006-4120010900-e019ba53b6f7a4b77aec
Wiley ID 1474448