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

*Links on SpectraBase are not permalinks.
(4RS,5S,8R,9RS)-4a,5,6,7,8,9a,10-octahydro-5,8-methano-1,4-anthraquinone
SpectraBase Compound ID 4SevhohVJxv
InChI InChI=1S/C15H16O2/c16-14-3-4-15(17)13-7-11-9-2-1-8(5-9)10(11)6-12(13)14/h3-4,8-9,12-13H,1-2,5-7H2/t8-,9+,12?,13?
InChIKey DJOLFPKYQLMYJL-RFZWMSCOSA-N
Mol Weight 228.29 g/mol
Molecular Formula C15H16O2
Exact Mass 228.11503 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 3QtucUWDbV6
Name (4RS,5S,8R,9RS)-4a,5,6,7,8,9a,10-octahydro-5,8-methano-1,4-anthraquinone
CAS Registry Number 104873-57-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O2
InChI InChI=1S/C15H16O2/c16-14-3-4-15(17)13-7-11-9-2-1-8(5-9)10(11)6-12(13)14/h3-4,8-9,12-13H,1-2,5-7H2/t8-,9+,12?,13?
InChIKey DJOLFPKYQLMYJL-RFZWMSCOSA-N
Molecular Weight 228.291 g/mol
SMILES C12=C(CC3C(C2)C(C=CC3=O)=O)[C@@]2([H])C[C@@]1(CC2)[H]
SPLASH splash10-0fb9-0090000000-cdb071bc5ab92ed676b3
Source of Spectrum H-68-1725-13
Synonyms (1R,12S)-tetracyclo[10.2.1.0(2,11).0(4,9)]pentadeca-2(11),6-diene-5,8-dione
Wiley ID 1230144