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4-Methyl-1-(1'-methyl-2'-phenylindol-3'-yl)-4-nitro-3-phenylpentan-1-one
SpectraBase Compound ID FRxS7zpXqhF
InChI InChI=1S/C27H26N2O3/c1-27(2,29(31)32)22(19-12-6-4-7-13-19)18-24(30)25-21-16-10-11-17-23(21)28(3)26(25)20-14-8-5-9-15-20/h4-17,22H,18H2,1-3H3
InChIKey FAUVIPUQTQYKMP-UHFFFAOYSA-N
Mol Weight 426.52 g/mol
Molecular Formula C27H26N2O3
Exact Mass 426.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8hCKRLdnI1
Name 4-Methyl-1-(1'-methyl-2'-phenylindol-3'-yl)-4-nitro-3-phenylpentan-1-one
Alternate Name(s) 4-Methyl-1-(1-methyl-2-phenyl-1H-indol-3-yl)-4-nitro-3-phenyl-1-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26N2O3
InChI InChI=1S/C27H26N2O3/c1-27(2,29(31)32)22(19-12-6-4-7-13-19)18-24(30)25-21-16-10-11-17-23(21)28(3)26(25)20-14-8-5-9-15-20/h4-17,22H,18H2,1-3H3
InChIKey FAUVIPUQTQYKMP-UHFFFAOYSA-N
Molecular Weight 426.516 g/mol
SMILES c1(c([n](C)c2c1cccc2)-c1ccccc1)C(CC(C(N(=O)=O)(C)C)c1ccccc1)=O
SPLASH splash10-001i-0590000000-edc62bd9e92980d33959
Source of Spectrum B-45-611-0
Wiley ID 1380071