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3-bromanyl-1-methylsulfanyl-5,6,7,8-tetrahydroisoquinoline
SpectraBase Compound ID 7fk8DD4KexZ
InChI InChI=1S/C10H12BrNS/c1-13-10-8-5-3-2-4-7(8)6-9(11)12-10/h6H,2-5H2,1H3
InChIKey GTYLUJCKTUINQB-UHFFFAOYSA-N
Mol Weight 258.18 g/mol
Molecular Formula C10H12BrNS
Exact Mass 256.987384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AqUAzXApgib
Name 3-bromanyl-1-methylsulfanyl-5,6,7,8-tetrahydroisoquinoline
CAS Registry Number 128736-36-7
Comments Less than 3 mono-isotopic peaks
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Formula C10H12BrNS
InChI InChI=1S/C10H12BrNS/c1-13-10-8-5-3-2-4-7(8)6-9(11)12-10/h6H,2-5H2,1H3
InChIKey GTYLUJCKTUINQB-UHFFFAOYSA-N
Molecular Weight 258.177 g/mol
SMILES c1(nc(cc2CCCCc12)Br)SC
SPLASH splash10-0a4i-0090000000-a366a0f975019e53424d
Source of Spectrum F-46-2571-9
Synonyms 3-Bromo-1-(methylthio)-5,6,7,8-tetrahydroisoquinoline
Wiley ID 1260518