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3-(Indol-2-yl)-1-methylthio-5,6,7,8-tetrahydroisoquinoline
SpectraBase Compound ID KBJn07i1sf7
InChI InChI=1S/C18H18N2S/c1-21-18-14-8-4-2-6-12(14)10-17(20-18)16-11-13-7-3-5-9-15(13)19-16/h3,5,7,9-11,19H,2,4,6,8H2,1H3
InChIKey YPLMMBVGKBTSEX-UHFFFAOYSA-N
Mol Weight 294.42 g/mol
Molecular Formula C18H18N2S
Exact Mass 294.11907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CieIbbK8kW
Name 3-(Indol-2-yl)-1-methylthio-5,6,7,8-tetrahydroisoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2S
InChI InChI=1S/C18H18N2S/c1-21-18-14-8-4-2-6-12(14)10-17(20-18)16-11-13-7-3-5-9-15(13)19-16/h3,5,7,9-11,19H,2,4,6,8H2,1H3
InChIKey YPLMMBVGKBTSEX-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol052255t
Molecular Weight 294.416 g/mol
SMILES [nH]1c(cc2c1cccc2)-c1cc2c(c(n1)SC)CCCC2
SPLASH splash10-03dl-0090000000-1155ffe2c698e245824f
Source of Spectrum A1-8-367/SM2-3b
Synonyms 3-(1H-indol-2-yl)-1-(methylthio)-5,6,7,8-tetrahydroisoquinoline 3-(1H-indol-2-yl)-1-methylsulfanyl-5,6,7,8-tetrahydroisoquinoline
Wiley ID 1760863