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1-Chloro-3,4,5,6,7,8-hexahydro[2.2]paracyclophane-1,9-diene
SpectraBase Compound ID 5zIk76qAgLm
InChI InChI=1S/C16H17Cl/c17-16-11-14-5-3-12(4-6-14)1-2-13-7-9-15(16)10-8-13/h1-2,7-12,14H,3-6H2/b2-1-,16-11+
InChIKey SSDAAWNAOMYFNL-QVTHNMBSSA-N
Mol Weight 244.76 g/mol
Molecular Formula C16H17Cl
Exact Mass 244.101878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CuXIUYkrQR5
Name 1-Chloro-3,4,5,6,7,8-hexahydro[2.2]paracyclophane-1,9-diene
Comments Less than 3 mono-isotopic peaks
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Formula C16H17Cl
InChI InChI=1S/C16H17Cl/c17-16-11-14-5-3-12(4-6-14)1-2-13-7-9-15(16)10-8-13/h1-2,7-12,14H,3-6H2/b2-1-,16-11+
InChIKey SSDAAWNAOMYFNL-QVTHNMBSSA-N
Molecular Weight 244.765 g/mol
SMILES C12\C=C/(c3ccc(\C=C/C(CC2)CC1)cc3)Cl
SPLASH splash10-0a4l-0970000000-e4f23c04f7b522bfc126
Source of Spectrum J-62-2730-10
Synonyms 3-chlorotricyclo[8.2.2.2(4,7)]hexadeca-2,4,6,8,15-pentaene
Wiley ID 1247421