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1,3-Diphenyl-2-cyclopenta[l]phenanthrenone
SpectraBase Compound ID DjQepxaTOqX
InChI InChI=1S/C29H18O/c30-29-25(19-11-3-1-4-12-19)27-23-17-9-7-15-21(23)22-16-8-10-18-24(22)28(27)26(29)20-13-5-2-6-14-20/h1-18H
InChIKey MNSDGJFEKUKHGO-UHFFFAOYSA-N
Mol Weight 382.46 g/mol
Molecular Formula C29H18O
Exact Mass 382.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jldNoSony6
Name 1,3-Diphenyl-2-cyclopenta[l]phenanthrenone
Alternate Name(s) 1,3-Diphenyl-2H-cyclopenta[l]phenanthren-2-one 1,3-Diphenylcyclopenta[l]phenanthren-2-one Phencyclone EINECS 227-112-4
CAS Registry Number 5660-91-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H18O
InChI InChI=1S/C29H18O/c30-29-25(19-11-3-1-4-12-19)27-23-17-9-7-15-21(23)22-16-8-10-18-24(22)28(27)26(29)20-13-5-2-6-14-20/h1-18H
InChIKey MNSDGJFEKUKHGO-UHFFFAOYSA-N
Molecular Weight 382.462 g/mol
SMILES C1(=O)C(=C2C(c3ccccc3-c3ccccc23)=C1c1ccccc1)c1ccccc1
SPLASH splash10-0ue9-0109000000-105d9500c6ee952dd0de
Source of Spectrum Y-59-142-5
Wiley ID 1583695