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3-(Allyloxy)-5-chloro-1-methyl-3-phenylindolin-2-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

3-(Allyloxy)-5-chloro-1-methyl-3-phenylindolin-2-one
SpectraBase Compound ID IMKOZ7iWYv6
InChI InChI=1S/C18H16ClNO2/c1-3-11-22-18(13-7-5-4-6-8-13)15-12-14(19)9-10-16(15)20(2)17(18)21/h3-10,12H,1,11H2,2H3
InChIKey ODNHVWNBMSXVQD-UHFFFAOYSA-N
Mol Weight 313.78 g/mol
Molecular Formula C18H16ClNO2
Exact Mass 313.086956 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ax5OceRNWMn
Name 3-(Allyloxy)-5-chloro-1-methyl-3-phenylindolin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 313.086956457 u
Formula C18H16ClNO2
InChI InChI=1S/C18H16ClNO2/c1-3-11-22-18(13-7-5-4-6-8-13)15-12-14(19)9-10-16(15)20(2)17(18)21/h3-10,12H,1,11H2,2H3
InChIKey ODNHVWNBMSXVQD-UHFFFAOYSA-N
Molecular Weight 313.784 g/mol
SMILES C1(N(C=2C=CC(=CC2C1(C=1C=CC=CC1)OCC=C)Cl)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941179