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5-(3-Bromophenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
SpectraBase Compound ID AoJIrjmRyTa
InChI InChI=1S/C25H22BrNO/c1-25(2)13-19-22-18-9-4-3-6-15(18)10-11-20(22)27-24(23(19)21(28)14-25)16-7-5-8-17(26)12-16/h3-12,24,27H,13-14H2,1-2H3
InChIKey DSQADTIMDSAVQD-UHFFFAOYSA-N
Mol Weight 432.36 g/mol
Molecular Formula C25H22BrNO
Exact Mass 431.088477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQP6lSsLo8N
Name 5-(3-Bromophenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
CAS Registry Number 22949-39-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22BrNO
InChI InChI=1S/C25H22BrNO/c1-25(2)13-19-22-18-9-4-3-6-15(18)10-11-20(22)27-24(23(19)21(28)14-25)16-7-5-8-17(26)12-16/h3-12,24,27H,13-14H2,1-2H3
InChIKey DSQADTIMDSAVQD-UHFFFAOYSA-N
Molecular Weight 432.361 g/mol
SMILES N1c2ccc3c(c2C2=C(C1c1cc(Br)ccc1)C(CC(C2)(C)C)=O)cccc3
SPLASH splash10-004i-2590000000-129cbe51af80e4a699f4
Source of Spectrum AD-0-2532-0
Synonyms 5-(3-bromophenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Benzo[a]phenanthridin-4(3H)-one, 1,2,5,6-tetrahydro-2,2-dimethyl-5-(3-bromophenyl)-
Wiley ID 1426380