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5-exo-Chloro-4,5,6,7-tetrahydro-4,7-methano-8-anti-(4-nitrophenylthio)-2-benzothiophene
SpectraBase Compound ID HXeqNI4nboY
InChI InChI=1S/C15H12ClNO2S2/c16-13-5-10-11-6-20-7-12(11)14(13)15(10)21-9-3-1-8(2-4-9)17(18)19/h1-4,6-7,10,13-15H,5H2/t10-,13+,14-,15?/m0/s1
InChIKey JOFRSTKIDCUEHR-KGZXPJFCSA-N
Mol Weight 337.84 g/mol
Molecular Formula C15H12ClNO2S2
Exact Mass 336.999799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVHVhpnrEa
Name 5-exo-Chloro-4,5,6,7-tetrahydro-4,7-methano-8-anti-(4-nitrophenylthio)-2-benzothiophene
Alternate Name(s) 8-Chloro-10-[(4-nitrophenyl)sulfanyl]-4-thiatricyclo[5.2.1.0(2,6)]deca-2,5-diene 8-Chloro-4-thiatricyclo[5.2.1.0(2,6)]deca-2,5-dien-10-yl 4-nitrophenyl sulfide
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Formula C15H12ClNO2S2
InChI InChI=1S/C15H12ClNO2S2/c16-13-5-10-11-6-20-7-12(11)14(13)15(10)21-9-3-1-8(2-4-9)17(18)19/h1-4,6-7,10,13-15H,5H2/t10-,13+,14-,15?/m0/s1
InChIKey JOFRSTKIDCUEHR-KGZXPJFCSA-N
Molecular Weight 337.839 g/mol
SMILES c12c([C@]3(C([C@@]2([C@@](C3)(Cl)[H])[H])Sc2ccc(N(=O)=O)cc2)[H])csc1
SPLASH splash10-000j-0900000000-3762a802580cc3cbb48e
Source of Spectrum AJ-72-1603-40
Wiley ID 775035