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1,4-Methanobiphenylen-9-ol, 2-chloro-1,2,3,4,4a,8b-hexahydro-, acetate, (1.alpha.,2.alpha.,4.alpha.,4a.alpha.,8b.alpha.,9S*)-

View entire compound with spectra: 1 MS (GC)

1,4-Methanobiphenylen-9-ol, 2-chloro-1,2,3,4,4a,8b-hexahydro-, acetate, (1.alpha.,2.alpha.,4.alpha.,4a.alpha.,8b.alpha.,9S*)-
SpectraBase Compound ID 4tARAL50eBM
InChI InChI=1S/C15H15ClO2/c1-7(17)18-15-10-6-11(16)14(15)13-9-5-3-2-4-8(9)12(10)13/h2-5,10-15H,6H2,1H3/t10-,11+,12-,13-,14+,15+/m1/s1
InChIKey YKQGBPCFELOJLA-QLKXBERHSA-N
Mol Weight 262.74 g/mol
Molecular Formula C15H15ClO2
Exact Mass 262.076057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fkB6CiGNMf
Name 1,4-Methanobiphenylen-9-ol, 2-chloro-1,2,3,4,4a,8b-hexahydro-, acetate, (1.alpha.,2.alpha.,4.alpha.,4a.alpha.,8b.alpha.,9S*)-
Alternate Name(s) (1S,2S,9R,10R,11R,13S)-11-chlorotetracyclo[8.2.1.0(2,9).0(3,8)]trideca-3,5,7-trien-13-yl acetate 1,4-Methanobiphenylen-9-ol, 2-chloro-1,2,3,4,4a,8b-hexahydro-, acetate, (1.alpha.,2.alpha.,4.alpha.,4a.alpha.,8b.alpha.,9s@)-
CAS Registry Number 52027-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15ClO2
InChI InChI=1S/C15H15ClO2/c1-7(17)18-15-10-6-11(16)14(15)13-9-5-3-2-4-8(9)12(10)13/h2-5,10-15H,6H2,1H3/t10-,11+,12-,13-,14+,15+/m1/s1
InChIKey YKQGBPCFELOJLA-QLKXBERHSA-N
Molecular Weight 262.736 g/mol
SMILES [C@]12([C@]3([C@@]([H])([C@@]([C@@]2(OC(=O)C)[H])([H])C[C@@]1(Cl)[H])c1c3cccc1)[H])[H]
SPLASH splash10-014l-2900000000-bc83a658e8fea9f431b0
Source of Spectrum W5-0-0-0
Wiley ID 1265768