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5,9-Methano-5H-benzocycloheptene, 6,7-dichloro-6,9-dihydro-, (5.alpha.,6.alpha.,9.alpha.)-
SpectraBase Compound ID EO63ledqJOK
InChI InChI=1S/C12H10Cl2/c13-11-6-7-5-10(12(11)14)9-4-2-1-3-8(7)9/h1-4,6-7,10,12H,5H2/t7-,10-,12+/m1/s1
InChIKey QLVANYFBZRRXRH-XXFPWJFMSA-N
Mol Weight 225.12 g/mol
Molecular Formula C12H10Cl2
Exact Mass 224.015956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4ykm7B5GK6
Name 5,9-Methano-5H-benzocycloheptene, 6,7-dichloro-6,9-dihydro-, (5.alpha.,6.alpha.,9.alpha.)-
CAS Registry Number 54647-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Cl2
InChI InChI=1S/C12H10Cl2/c13-11-6-7-5-10(12(11)14)9-4-2-1-3-8(7)9/h1-4,6-7,10,12H,5H2/t7-,10-,12+/m1/s1
InChIKey QLVANYFBZRRXRH-XXFPWJFMSA-N
Molecular Weight 225.118 g/mol
SMILES [C@@]12(c3c(cccc3)[C@](C1)(C=C([C@]2(Cl)[H])Cl)[H])[H]
SPLASH splash10-0ufu-0930000000-d3505608d7d485fd1143
Source of Spectrum C-101-5715-0
Synonyms (1R,8R,11S)-10,11-dichlorotricyclo[6.3.1.0(2,7)]dodeca-2,4,6,9-tetraene endo-3,4-dichloro-6,7-benzylbicyclo(3.2.1)octa-3,6-diene
Wiley ID 1224840