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Bicyclo[3.1.1]heptane, 6-chloro-7-cyclopentylidene-, (1.alpha.,5.alpha.,6.alpha.)-
SpectraBase Compound ID 733xsyJDizs
InChI InChI=1S/C12H17Cl/c13-12-9-6-3-7-10(12)11(9)8-4-1-2-5-8/h9-10,12H,1-7H2/t9-,10+,12+
InChIKey FUQABZPWWUFWHN-IAZYJMLFSA-N
Mol Weight 196.72 g/mol
Molecular Formula C12H17Cl
Exact Mass 196.101878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FO3pVTPt0M8
Name Bicyclo[3.1.1]heptane, 6-chloro-7-cyclopentylidene-, (1.alpha.,5.alpha.,6.alpha.)-
CAS Registry Number 120545-99-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17Cl
InChI InChI=1S/C12H17Cl/c13-12-9-6-3-7-10(12)11(9)8-4-1-2-5-8/h9-10,12H,1-7H2/t9-,10+,12+
InChIKey FUQABZPWWUFWHN-IAZYJMLFSA-N
Molecular Weight 196.721 g/mol
SMILES C1([C@@]2(CCC[C@]1([C@]2(Cl)[H])[H])[H])=C1CCCC1
SPLASH splash10-03xu-4900000000-33d2e31beec8141a8be1
Source of Spectrum K-122-1525-31
Synonyms (1R,5S)-6-chloro-7-cyclopentylidenebicyclo[3.1.1]heptane endo-6-chloro-7-cyclopentylidenebicyclo[3.1.1]heptane
Wiley ID 1193331