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7-Chloranyl-2-(4-methoxyphenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
SpectraBase Compound ID AgwocaisQvM
InChI InChI=1S/C22H18ClNOS/c1-25-18-10-7-16(8-11-18)22-14-19(15-5-3-2-4-6-15)24-20-13-17(23)9-12-21(20)26-22/h2-13,22H,14H2,1H3
InChIKey FQHSHSUCQSXYJT-UHFFFAOYSA-N
Mol Weight 379.91 g/mol
Molecular Formula C22H18ClNOS
Exact Mass 379.079763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xtGfgTYacw
Name 7-Chloranyl-2-(4-methoxyphenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Alternate Name(s) 7-Chloro-2-(4-methoxyphenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18ClNOS
InChI InChI=1S/C22H18ClNOS/c1-25-18-10-7-16(8-11-18)22-14-19(15-5-3-2-4-6-15)24-20-13-17(23)9-12-21(20)26-22/h2-13,22H,14H2,1H3
InChIKey FQHSHSUCQSXYJT-UHFFFAOYSA-N
Molecular Weight 379.905 g/mol
SMILES C1(=Nc2c(SC(C1)c1ccc(cc1)OC)ccc(c2)Cl)c1ccccc1
SPLASH splash10-001j-0960000000-94bde51c29949d678d86
Source of Spectrum SK-30-4458-5
Wiley ID 881641