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1-Phenyl-2,3,4,5-tetrahydro-3(N)-acetylpyrido[3,4-b]indene
SpectraBase Compound ID JKtoc5BJHaz
InChI InChI=1S/C20H19NO/c1-14(22)21-12-17-11-16-9-5-6-10-18(16)20(17)19(13-21)15-7-3-2-4-8-15/h2-10,19H,11-13H2,1H3
InChIKey XHQKBVUVICYOLN-UHFFFAOYSA-N
Mol Weight 289.38 g/mol
Molecular Formula C20H19NO
Exact Mass 289.146664 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2oaovl7ufZI
Name 1-Phenyl-2,3,4,5-tetrahydro-3(N)-acetylpyrido[3,4-B]indene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.146664235 u
Formula C20H19NO
InChI InChI=1S/C20H19NO/c1-14(22)21-12-17-11-16-9-5-6-10-18(16)20(17)19(13-21)15-7-3-2-4-8-15/h2-10,19H,11-13H2,1H3
InChIKey XHQKBVUVICYOLN-UHFFFAOYSA-N
SMILES C12=C(CN(CC2C=2C=CC=CC2)C(=O)C)CC=2C1=CC=CC2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865642