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N-(4-methyl-2-(methylthio)phenyl)benzamide
SpectraBase Compound ID 9YaITbAVN0i
InChI InChI=1S/C15H15NOS/c1-11-8-9-13(14(10-11)18-2)16-15(17)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,16,17)
InChIKey SSHKMQVPWDRWAS-UHFFFAOYSA-N
Mol Weight 257.35 g/mol
Molecular Formula C15H15NOS
Exact Mass 257.087435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hlx6d3l4Du
Name N-(4-methyl-2-(methylthio)phenyl)benzamide
Appearance Off-white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NOS
GC Oven Program Oven temp 290 oC or 320 oC
InChI InChI=1S/C15H15NOS/c1-11-8-9-13(14(10-11)18-2)16-15(17)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,16,17)
InChIKey SSHKMQVPWDRWAS-UHFFFAOYSA-N
Instrument Name Agilent Technologies 7890A-5975C VL/5975 inert GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.201609393
Molecular Weight 257.351 g/mol
Quality 190
Reported Formula C15H15NOS
SMILES N(C1=CC=C(C=C1SC)C)C(=O)C=1C=CC=CC1
SPLASH splash10-08i0-5490000000-124c153c90045ba14929
Sample Comments Minor
Source of Spectrum ACI-56-SM49-6m1 (DOI: 10.1002/anie.201609393)
Thin-Layer Chromatography 0.32 (Pentane/EtOAc, 9:1)
Wiley ID 1892816