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anti-12-Chloro-tricyclo(5.4.1.0/3,5/)dodeca-1,3(5),6,8,10-pentaene
SpectraBase Compound ID 6C5aKafRDDb
InChI InChI=1S/C12H9Cl/c13-12-8-3-1-2-4-9(12)6-11-7-10(11)5-8/h1-6,12H,7H2
InChIKey QPNBLTAZSMWHID-UHFFFAOYSA-N
Mol Weight 188.66 g/mol
Molecular Formula C12H9Cl
Exact Mass 188.039278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlyCLY0XvU
Name anti-12-Chlorotricyclo[5.4.1.0(3,5)]dodeca-1,3(5),6,8,10-pentaene
Alternate Name(s) 12-chlorotricyclo[5.4.1.0(3,5)]dodeca-1,3(5),6,8,10-pentaene
Comments Less than 3 mono-isotopic peaks
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Formula C12H9Cl
InChI InChI=1S/C12H9Cl/c13-12-8-3-1-2-4-9(12)6-11-7-10(11)5-8/h1-6,12H,7H2
InChIKey QPNBLTAZSMWHID-UHFFFAOYSA-N
Molecular Weight 188.657 g/mol
SMILES C12=C(C=C3C=CC=CC(=C2)C3Cl)C1
SPLASH splash10-0udi-0900000000-395f111ae9980c4dfe97
Source of Spectrum KC-1992-722-18
Wiley ID 776048