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3-[1-(4-Chlorophenyl)-1-methyl-3-thiophen-3-yl-prop-2-ynyl]-1-methyl-1H-indole
SpectraBase Compound ID 3HKIinJ0wo9
InChI InChI=1S/C23H18ClNS/c1-23(13-11-17-12-14-26-16-17,18-7-9-19(24)10-8-18)21-15-25(2)22-6-4-3-5-20(21)22/h3-10,12,14-16H,1-2H3
InChIKey VSVLCHGUJNJYQC-UHFFFAOYSA-N
Mol Weight 375.92 g/mol
Molecular Formula C23H18ClNS
Exact Mass 375.084848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2go2ckk6x0E
Name 3-[1-(4-Chlorophenyl)-1-methyl-3-thiophen-3-yl-prop-2-ynyl]-1-methyl-1H-indole
Appearance Pale brown solid
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Formula C23H18ClNS
InChI InChI=1S/C23H18ClNS/c1-23(13-11-17-12-14-26-16-17,18-7-9-19(24)10-8-18)21-15-25(2)22-6-4-3-5-20(21)22/h3-10,12,14-16H,1-2H3
InChIKey VSVLCHGUJNJYQC-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.7.89
Molecular Weight 375.917 g/mol
Reported Formula C23H18ClNS
SMILES c1ccc2[n](cc(C(C#Cc3ccsc3)(c3ccc(cc3)Cl)C)c2c1)C
SPLASH splash10-03di-0009000000-c529755696f9fc540193
Source of Spectrum BJO-7-SM2-1f
Thin-Layer Chromatography Rf = 0.18 (hexane/AcOEt, 5:1)
Wiley ID 1867237