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1,4-Methanobiphenylen-9-ol, 2-chloro-1,2,3,4,4a,8b-hexahydro-, (1.alpha.,2.alpha.,4.alpha.,4a.beta.,8b.beta.,9R*)-
SpectraBase Compound ID IRoIFHI0sDh
InChI InChI=1S/C13H13ClO/c14-9-5-8-10-6-3-1-2-4-7(6)11(10)12(9)13(8)15/h1-4,8-13,15H,5H2/t8-,9+,10+,11+,12+,13-/m1/s1
InChIKey NKIFCYBPHSTSKG-LIBFEPKXSA-N
Mol Weight 220.7 g/mol
Molecular Formula C13H13ClO
Exact Mass 220.065493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ez7hRuFQ7CU
Name 1,4-Methanobiphenylen-9-ol, 2-chloro-1,2,3,4,4a,8b-hexahydro-, (1.alpha.,2.alpha.,4.alpha.,4a.beta.,8b.beta.,9R*)-
CAS Registry Number 51957-29-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClO
InChI InChI=1S/C13H13ClO/c14-9-5-8-10-6-3-1-2-4-7(6)11(10)12(9)13(8)15/h1-4,8-13,15H,5H2/t8-,9+,10+,11+,12+,13-/m1/s1
InChIKey NKIFCYBPHSTSKG-LIBFEPKXSA-N
Molecular Weight 220.699 g/mol
SMILES O[C@@]1([C@]2([H])C[C@@]([C@]1([C@@]1([C@@]2([H])c2c1cccc2)[H])[H])(Cl)[H])[H]
SPLASH splash10-004i-0900000000-1a066e139b8800cca5eb
Source of Spectrum W5-0-0-0
Synonyms (1S,2R,9S,10R,11R,13R)-11-chlorotetracyclo[8.2.1.0(2,9).0(3,8)]trideca-3,5,7-trien-13-ol 1,4-Methanobiphenylen-9-ol, 2-chloro-1,2,3,4,4a,8b-hexahydro-, (1.alpha.,2.alpha.,4.alpha.,4a.beta.,8b.beta.,9r@)-
Wiley ID 1219816