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exo-10-(p-Chlorophenyl)benzo[c]-3-thiatetracyclo[10.2.1.0.0]hexadec-4-ene
SpectraBase Compound ID 9JbPadB7jHf
InChI InChI=1S/C24H23ClS/c25-18-10-7-15(8-11-18)21-20-12-9-14-3-1-2-4-19(14)24(20)26-23-17-6-5-16(13-17)22(21)23/h1-4,7-8,10-11,16-17,21-23H,5-6,9,12-13H2/t16-,17+,21?,22+,23?/m1/s1
InChIKey FQAKMWURSLQYDX-TZEQVAKCSA-N
Mol Weight 378.96 g/mol
Molecular Formula C24H23ClS
Exact Mass 378.1209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlTqa5MY070
Name exo-10-(p-Chlorophenyl)benzo[c]-3-thiatetracyclo[10.2.1.0.0]hexadec-4-ene
CAS Registry Number 71436-39-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23ClS
InChI InChI=1S/C24H23ClS/c25-18-10-7-15(8-11-18)21-20-12-9-14-3-1-2-4-19(14)24(20)26-23-17-6-5-16(13-17)22(21)23/h1-4,7-8,10-11,16-17,21-23H,5-6,9,12-13H2/t16-,17+,21?,22+,23?/m1/s1
InChIKey FQAKMWURSLQYDX-TZEQVAKCSA-N
Molecular Weight 378.961 g/mol
SMILES C12=C(C(c3ccc(cc3)Cl)[C@]3(C(S1)[C@@]1(C[C@]3(CC1)[H])[H])[H])CCc1c2cccc1
SPLASH splash10-003s-0095000000-64a06a8ba7586273412d
Source of Spectrum J-44-4155-0
Synonyms 14-(4-chlorophenyl)-3-thiapentacyclo[14.2.1.0(2,15).0(4,13).0(5,10)]nonadeca-4(13),5,7,9-tetraene
Wiley ID 1358982