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1-(2'-Phenyl-1',3'-dithian-2'-yl)-isoquinoline

View entire compound with spectra: 1 MS (GC)

1-(2'-Phenyl-1',3'-dithian-2'-yl)-isoquinoline
SpectraBase Compound ID Cazc110W5Df
InChI InChI=1S/C19H17NS2/c1-2-8-16(9-3-1)19(21-13-6-14-22-19)18-17-10-5-4-7-15(17)11-12-20-18/h1-5,7-12H,6,13-14H2
InChIKey RNVSCSWGLSIOKI-UHFFFAOYSA-N
Mol Weight 323.47 g/mol
Molecular Formula C19H17NS2
Exact Mass 323.080242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YggC6UCDh1
Name 1-(2'-Phenyl-1',3'-dithian-2'-yl)-isoquinoline
Alternate Name(s) 1-(2-phenyl-1,3-dithian-2-yl)isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17NS2
InChI InChI=1S/C19H17NS2/c1-2-8-16(9-3-1)19(21-13-6-14-22-19)18-17-10-5-4-7-15(17)11-12-20-18/h1-5,7-12H,6,13-14H2
InChIKey RNVSCSWGLSIOKI-UHFFFAOYSA-N
Molecular Weight 323.472 g/mol
SMILES C1(c2c3c(cccc3)ccn2)(SCCCS1)c1ccccc1
SPLASH splash10-03xr-0960000000-4e0d1244a001d2e3e037
Source of Spectrum D8-323-328-19
Wiley ID 1513688