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5-(3-Bromophenyl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
SpectraBase Compound ID INgDXqin1P2
InChI InChI=1S/C23H18BrNO/c24-16-7-3-6-15(13-16)23-22-18(9-4-10-20(22)26)21-17-8-2-1-5-14(17)11-12-19(21)25-23/h1-3,5-8,11-13,23,25H,4,9-10H2
InChIKey VDWFDMKVYHLWRD-UHFFFAOYSA-N
Mol Weight 404.31 g/mol
Molecular Formula C23H18BrNO
Exact Mass 403.057177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATvqDhc70SQ
Name 5-(3-Bromophenyl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
CAS Registry Number 247138-33-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18BrNO
InChI InChI=1S/C23H18BrNO/c24-16-7-3-6-15(13-16)23-22-18(9-4-10-20(22)26)21-17-8-2-1-5-14(17)11-12-19(21)25-23/h1-3,5-8,11-13,23,25H,4,9-10H2
InChIKey VDWFDMKVYHLWRD-UHFFFAOYSA-N
Molecular Weight 404.307 g/mol
SMILES N1C(C2=C(c3c1ccc1c3cccc1)CCCC2=O)c1cc(ccc1)Br
SPLASH splash10-0002-3790000000-fed7f10dfa18ca1689d7
Synonyms 5-(3-Bromophenyl)-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-4-one 5-(3-bromophenyl)-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one
Wiley ID 1467872