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Dibenzo[a,j]coronene

View entire compound with spectra: 2 MS (GC)

Dibenzo[a,j]coronene
SpectraBase Compound ID HcB8aQPIoVE
InChI InChI=1S/C32H16/c1-2-6-20-19(5-1)23-13-9-17-11-15-25-21-7-3-4-8-22(21)26-16-12-18-10-14-24(20)30-28(18)32(26)31(25)27(17)29(23)30/h1-16H
InChIKey HHCCABYUXOGSCO-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C32H16
Exact Mass 400.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESSEi4sG05y
Name Dibenzo[a,j]coronene
Alternate Name(s) 1,2,7,8-Dibenzocoronene
CAS Registry Number 190-72-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H16
InChI InChI=1S/C32H16/c1-2-6-20-19(5-1)23-13-9-17-11-15-25-21-7-3-4-8-22(21)26-16-12-18-10-14-24(20)30-28(18)32(26)31(25)27(17)29(23)30/h1-16H
InChIKey HHCCABYUXOGSCO-UHFFFAOYSA-N
Molecular Weight 400.480 g/mol
SMILES c1c2c3c4c5c6c(ccc5c5c(c4c1)cccc5)ccc1c6c3c(cc2)c2c1cccc2
SPLASH splash10-0udi-0102900000-0ae7394b6ce36c502231
Wiley ID 1502504