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2-chloro-5-(cyclohexyl(4-methoxyphenyl)methyl)thiophene
SpectraBase Compound ID HLvH7AaqKhF
InChI InChI=1S/C18H21ClOS/c1-20-15-9-7-14(8-10-15)18(13-5-3-2-4-6-13)16-11-12-17(19)21-16/h7-13,18H,2-6H2,1H3
InChIKey KRCCTVXELLXHFT-UHFFFAOYSA-N
Mol Weight 320.88 g/mol
Molecular Formula C18H21ClOS
Exact Mass 320.100164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KwB0aBfWCzw
Name 2-chloro-5-(cyclohexyl(4-methoxyphenyl)methyl)thiophene
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21ClOS
InChI InChI=1S/C18H21ClOS/c1-20-15-9-7-14(8-10-15)18(13-5-3-2-4-6-13)16-11-12-17(19)21-16/h7-13,18H,2-6H2,1H3
InChIKey KRCCTVXELLXHFT-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.202016268
Molecular Weight 320.878 g/mol
SMILES c1(C(C2CCCCC2)c2sc(cc2)Cl)ccc(cc1)OC
SPLASH splash10-000i-1290000000-6dd0cb1f223e5e33023b
Source of Spectrum ACI-60-SM25-4a
Wiley ID 1880266