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8-(benzenesulfonyl)-3-(methylthio)-1-phenyl-5,6,7,8-tetrahydroisoquinoline
SpectraBase Compound ID CN0enPoLvhr
InChI InChI=1S/C22H21NO2S2/c1-26-20-15-17-11-8-14-19(27(24,25)18-12-6-3-7-13-18)21(17)22(23-20)16-9-4-2-5-10-16/h2-7,9-10,12-13,15,19H,8,11,14H2,1H3
InChIKey ZGMLZNLSJMFAAA-UHFFFAOYSA-N
Mol Weight 395.54 g/mol
Molecular Formula C22H21NO2S2
Exact Mass 395.101371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Z9NKs2WwG6
Name 8-(benzenesulfonyl)-3-(methylthio)-1-phenyl-5,6,7,8-tetrahydroisoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO2S2
InChI InChI=1S/C22H21NO2S2/c1-26-20-15-17-11-8-14-19(27(24,25)18-12-6-3-7-13-18)21(17)22(23-20)16-9-4-2-5-10-16/h2-7,9-10,12-13,15,19H,8,11,14H2,1H3
InChIKey ZGMLZNLSJMFAAA-UHFFFAOYSA-N
Molecular Weight 395.535 g/mol
SMILES c1(nc(cc2CCCC(c12)S(=O)(=O)c1ccccc1)SC)-c1ccccc1
SPLASH splash10-0ue9-0290000000-d51cbab681ee20db244d
Source of Spectrum E2-50-466-16
Synonyms 8-(benzenesulfonyl)-3-methylsulfanyl-1-phenyl-5,6,7,8-tetrahydroisoquinoline 8-besyl-3-(methylthio)-1-phenyl-5,6,7,8-tetrahydroisoquinoline
Wiley ID 1555853