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Pyrido[4,3-b]indole, 1,2,3,4,4a,9b-hexahydro-5-(4-fluorophenylsulfonyl)-2,8-dimethyl-
SpectraBase Compound ID CwVrYpachwt
InChI InChI=1S/C19H21FN2O2S/c1-13-3-8-18-16(11-13)17-12-21(2)10-9-19(17)22(18)25(23,24)15-6-4-14(20)5-7-15/h3-8,11,17,19H,9-10,12H2,1-2H3/t17-,19-/m0/s1
InChIKey OTLGTGQTFJKEOE-HKUYNNGSSA-N
Mol Weight 360.45 g/mol
Molecular Formula C19H21FN2O2S
Exact Mass 360.130777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kh67Pd7jKB
Name Pyrido[4,3-b]indole, 1,2,3,4,4a,9b-hexahydro-5-(4-fluorophenylsulfonyl)-2,8-dimethyl-
Alternate Name(s) (4aS,9bR)-5-(4-fluorophenyl)sulfonyl-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole (4aS,9bR)-5-(4-fluorophenyl)sulfonyl-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrid[4,3-b]indole (4aS,9bR)-5-[(4-fluorophenyl)sulfonyl]-2,8-dimethyl-2,3,4,4a,5,9b-hexahydro-1H-pyrido[4,3-b]indole 5-[(4-Fluorophenyl)sulfonyl]-2,8-dimethyl-2,3,4,4a,5,9b-hexahydro-1H-pyrido[4,3-b]indole
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Formula C19H21FN2O2S
InChI InChI=1S/C19H21FN2O2S/c1-13-3-8-18-16(11-13)17-12-21(2)10-9-19(17)22(18)25(23,24)15-6-4-14(20)5-7-15/h3-8,11,17,19H,9-10,12H2,1-2H3/t17-,19-/m0/s1
InChIKey OTLGTGQTFJKEOE-HKUYNNGSSA-N
Molecular Weight 360.447 g/mol
SMILES Cc1ccc2N(S(c3ccc(cc3)F)(=O)=O)[C@@]3([C@](CN(CC3)C)([H])c2c1)[H]
SPLASH splash10-0a4i-8900000000-f5eae9c7e55503250835
Source of Spectrum AD-0-2532-0
Wiley ID 1426462