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Isoquinoline, 1,2,3,4-tetrahydro-2-(2-thienylthioxomethyl)-
SpectraBase Compound ID XHfYLzAKDL
InChI InChI=1S/C14H13NS2/c16-14(13-6-3-9-17-13)15-8-7-11-4-1-2-5-12(11)10-15/h1-6,9H,7-8,10H2
InChIKey HLCSDAIMKBAMMO-UHFFFAOYSA-N
Mol Weight 259.38 g/mol
Molecular Formula C14H13NS2
Exact Mass 259.048942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ODFyWHEeTZ
Name Isoquinoline, 1,2,3,4-tetrahydro-2-(2-thienylthioxomethyl)-
Alternate Name(s) 1,3.4-trihydro-2-((2-furyl)(thioxo)methyl)-2H-isoquinoline 2-(2-Thienylcarbothioyl)-1,2,3,4-tetrahydroisoquinoline
CAS Registry Number 122710-00-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NS2
InChI InChI=1S/C14H13NS2/c16-14(13-6-3-9-17-13)15-8-7-11-4-1-2-5-12(11)10-15/h1-6,9H,7-8,10H2
InChIKey HLCSDAIMKBAMMO-UHFFFAOYSA-N
Molecular Weight 259.385 g/mol
SMILES C(N1Cc2ccccc2CC1)(c1sccc1)=S
SPLASH splash10-0api-0960000000-16c0571422d2ae6ee681
Source of Spectrum F-44-7281-0
Wiley ID 1262705