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[2-(Phenylmethylsulfanyl)-1H-indol-3-yl]phenylmethanone

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

[2-(Phenylmethylsulfanyl)-1H-indol-3-yl]phenylmethanone
SpectraBase Compound ID DETcdrXD6WN
InChI InChI=1S/C22H17NOS/c24-21(17-11-5-2-6-12-17)20-18-13-7-8-14-19(18)23-22(20)25-15-16-9-3-1-4-10-16/h1-14,23H,15H2
InChIKey LQBPLEAVJFBKIB-UHFFFAOYSA-N
Mol Weight 343.44 g/mol
Molecular Formula C22H17NOS
Exact Mass 343.103085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1wCdCjU6F3A
Name [2-(Phenylmethylsulfanyl)-1H-indol-3-yl]phenylmethanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.103085344 u
Formula C22H17NOS
InChI InChI=1S/C22H17NOS/c24-21(17-11-5-2-6-12-17)20-18-13-7-8-14-19(18)23-22(20)25-15-16-9-3-1-4-10-16/h1-14,23H,15H2
InChIKey LQBPLEAVJFBKIB-UHFFFAOYSA-N
Molecular Weight 343.444 g/mol
SMILES C1(=C(NC2=C1C=CC=C2)SCC=1C=CC=CC1)C(=O)C=1C=CC=CC1