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1-(2,3-Dihydroindol-1-yl)-4-phenyl-butan-1,4-dione

View entire compound with spectra: 1 NMR, and 1 FTIR

1-(2,3-Dihydroindol-1-yl)-4-phenyl-butan-1,4-dione
SpectraBase Compound ID HcyR4G5MSzO
InChI InChI=1S/C18H17NO2/c20-17(15-7-2-1-3-8-15)10-11-18(21)19-13-12-14-6-4-5-9-16(14)19/h1-9H,10-13H2
InChIKey YUVIYLIPARWYRA-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C18H17NO2
Exact Mass 279.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LPoTWHFMPbV
Name 1-(2,3-Dihydroindol-1-yl)-4-phenyl-butan-1,4-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.125928789 u
Formula C18H17NO2
InChI InChI=1S/C18H17NO2/c20-17(15-7-2-1-3-8-15)10-11-18(21)19-13-12-14-6-4-5-9-16(14)19/h1-9H,10-13H2
InChIKey YUVIYLIPARWYRA-UHFFFAOYSA-N
SMILES C(=O)(CCC(=O)N1C=2C(CC1)=CC=CC2)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970923