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6-Chloro-3,3a,4,5,6,8a-hexahydro-(3a.alpha.,6.beta.,8a.alpha.)-2H-cyclohepta[b]furan

View entire compound with spectra: 1 MS (GC)

6-Chloro-3,3a,4,5,6,8a-hexahydro-(3a.alpha.,6.beta.,8a.alpha.)-2H-cyclohepta[b]furan
SpectraBase Compound ID ExLulFZXPgW
InChI InChI=1S/C9H13ClO/c10-8-2-1-7-5-6-11-9(7)4-3-8/h3-4,7-9H,1-2,5-6H2/t7-,8-,9-/m1/s1
InChIKey KOLYILMXHJYIDC-IWSPIJDZSA-N
Mol Weight 172.65 g/mol
Molecular Formula C9H13ClO
Exact Mass 172.065493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3maLu33sQJc
Name 6-Chloro-3,3a,4,5,6,8a-hexahydro-(3a.alpha.,6.beta.,8a.alpha.)-2H-cyclohepta[b]furan
CAS Registry Number 141612-49-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13ClO
InChI InChI=1S/C9H13ClO/c10-8-2-1-7-5-6-11-9(7)4-3-8/h3-4,7-9H,1-2,5-6H2/t7-,8-,9-/m1/s1
InChIKey KOLYILMXHJYIDC-IWSPIJDZSA-N
Molecular Weight 172.655 g/mol
SMILES C1=C[C@@](CC[C@]2([C@@]1(OCC2)[H])[H])(Cl)[H]
SPLASH splash10-000i-9400000000-1e8c73e2be36f1940b99
Source of Spectrum C-114-6379-22
Synonyms (3aR,6R,8aS)-6-chloro-3,3a,4,5,6,8a-hexahydro-2H-cyclohepta[b]furan
Wiley ID 1168635