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4,8-Methanoazulene, 5-chloro-1,2,3,3a,4,7,8,8a-octahydro-, (3a.alpha.,4.alpha.,8.alpha.,8a.alpha.)-
SpectraBase Compound ID 1WLipLlbV2F
InChI InChI=1S/C11H15Cl/c12-11-5-4-7-6-10(11)9-3-1-2-8(7)9/h5,7-10H,1-4,6H2/t7-,8-,9-,10+/m1/s1
InChIKey IWTHPXIKZHEZLD-KYXWUPHJSA-N
Mol Weight 182.69 g/mol
Molecular Formula C11H15Cl
Exact Mass 182.086228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBtApXxtYAZ
Name 4,8-Methanoazulene, 5-chloro-1,2,3,3a,4,7,8,8a-octahydro-, (3a.alpha.,4.alpha.,8.alpha.,8a.alpha.)-
CAS Registry Number 54643-94-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15Cl
InChI InChI=1S/C11H15Cl/c12-11-5-4-7-6-10(11)9-3-1-2-8(7)9/h5,7-10H,1-4,6H2/t7-,8-,9-,10+/m1/s1
InChIKey IWTHPXIKZHEZLD-KYXWUPHJSA-N
Molecular Weight 182.694 g/mol
SMILES [C@]12([C@]3([C@@](CCC3)([H])[C@](C1)([H])CC=C2Cl)[H])[H]
SPLASH splash10-03di-5900000000-3baa092c86266d655928
Source of Spectrum J-40-1486-0
Synonyms (1R,2R,6R,7R)-8-chlorotricyclo[5.3.1.0(2,6)]undec-8-ene 3-Chloro-6,7-trimethlenebicyclo[3.2.1]oct-2-ene
Wiley ID 1178601