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(4aR,6R,8aS)-2,6-dimethyl-7-methylsulfanyl-3,4,4a,5,6,8a-hexahydro-1H-isoquinoline
SpectraBase Compound ID FhEyw9qiPkb
InChI InChI=1S/C12H21NS/c1-9-6-10-4-5-13(2)8-11(10)7-12(9)14-3/h7,9-11H,4-6,8H2,1-3H3/t9-,10+,11+/m1/s1
InChIKey SCZBPCZSVLPFDY-VWYCJHECSA-N
Mol Weight 211.37 g/mol
Molecular Formula C12H21NS
Exact Mass 211.139471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0fD5jd55K8
Name (4aR,6R,8aS)-2,6-dimethyl-7-(methylthio)-3,4,4a,5,6,8a-hexahydro-1H-isoquinoline
Alternate Name(s) (4aR,6R,8aS)-2,6-dimethyl-7-methylsulfanyl-3,4,4a,5,6,8a-hexahydro-1H-isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NS
InChI InChI=1S/C12H21NS/c1-9-6-10-4-5-13(2)8-11(10)7-12(9)14-3/h7,9-11H,4-6,8H2,1-3H3/t9-,10+,11+/m1/s1
InChIKey SCZBPCZSVLPFDY-VWYCJHECSA-N
Molecular Weight 211.367 g/mol
SMILES C1=C([C@](C)(C[C@]2([C@@]1(CN(CC2)C)[H])[H])[H])SC
SPLASH splash10-03dj-4930000000-9241e02daf22c8451234
Source of Spectrum F-54-9554-42
Wiley ID 808253