For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,4:5,8-Dimethanonaphthalen-2(1H)-one, octahydro-9-(phenylmethoxy)-, (1.alpha.,4.alpha.,4a.alpha.,5.beta.,8.beta.,8a.alpha.,9R*)-
SpectraBase Compound ID 23pXuUrzCa7
InChI InChI=1S/C19H22O2/c20-15-9-14-16-12-6-7-13(8-12)17(16)18(15)19(14)21-10-11-4-2-1-3-5-11/h1-5,12-14,16-19H,6-10H2/t12-,13+,14-,16-,17-,18+,19-/m1/s1
InChIKey BNSIFDUTCGWZMG-WIYBQETGSA-N
Mol Weight 282.38 g/mol
Molecular Formula C19H22O2
Exact Mass 282.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BiiWF0AmkuF
Name 1,4:5,8-Dimethanonaphthalen-2(1H)-one, octahydro-9-(phenylmethoxy)-, (1.alpha.,4.alpha.,4a.alpha.,5.beta.,8.beta.,8a.alpha.,9R*)-
CAS Registry Number 80119-06-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O2
InChI InChI=1S/C19H22O2/c20-15-9-14-16-12-6-7-13(8-12)17(16)18(15)19(14)21-10-11-4-2-1-3-5-11/h1-5,12-14,16-19H,6-10H2/t12-,13+,14-,16-,17-,18+,19-/m1/s1
InChIKey BNSIFDUTCGWZMG-WIYBQETGSA-N
Molecular Weight 282.383 g/mol
SMILES [C@]12([C@]3([C@@]([C@@]4([H])C[C@@]3(CC4)[H])([H])[C@@]([C@]2(OCc2ccccc2)[H])([H])CC1=O)[H])[H]
SPLASH splash10-0006-9300000000-d8f8dfb96c49c898ddc3
Source of Spectrum K-114-3345-0
Synonyms (1S,2R,3R,6S,7S,8R,12R)-12-(benzyloxy)tetracyclo[6.2.1.1(3,6).0(2,7)]dodecan-4-one 11-anti-benzyloxy-endo,exo-tetracyclo[6.2.1.1(3,6).0.(2,7)]dodecan-4-one
Wiley ID 1286393