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

*Links on SpectraBase are not permalinks.
Cyclopenta[f][1]benzopyran-3,7-dione, decahydro-6a-methyl-, [4aS-(4a.alpha.,6a.alpha.,9a.beta.,9b.alpha.)]-
SpectraBase Compound ID 4UbQdKNXlWv
InChI InChI=1S/C13H18O3/c1-13-7-6-10-8(2-5-12(15)16-10)9(13)3-4-11(13)14/h8-10H,2-7H2,1H3/t8-,9-,10+,13-/m1/s1
InChIKey IFSUJJKLAULFLL-ORXSELOVSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 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 Aw1fPwnGyQi
Name Cyclopenta[f][1]benzopyran-3,7-dione, decahydro-6a-methyl-, [4aS-(4a.alpha.,6a.alpha.,9a.beta.,9b.alpha.)]-
CAS Registry Number 64053-02-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-13-7-6-10-8(2-5-12(15)16-10)9(13)3-4-11(13)14/h8-10H,2-7H2,1H3/t8-,9-,10+,13-/m1/s1
InChIKey IFSUJJKLAULFLL-ORXSELOVSA-N
Molecular Weight 222.284 g/mol
SMILES [C@]12([C@@]([C@]3(CCC(O[C@]3(CC2)[H])=O)[H])(CCC1=O)[H])C
SPLASH splash10-06fr-4910000000-2b14e5a4814f3fb34aa8
Source of Spectrum F-37-1749-0
Synonyms (4aS,6aR,9aR,9bR)-6a-methyldecahydrocyclopenta[f]chromene-3,7-dione 3a.alpha.H-4.alpha.-[3'-propionic acid]-5.alpha.-hydroxy-7a.beta.-methyl-hexahydro-1-indanone-.delta.-lactone 4-Indanpropionic acid, 3a.alpha.,4.beta.,5,6,7,7a-hexahydro-5.alpha.-hydroxy-7a.beta.-methyl -1-oxo-, .delta.-lactone
Wiley ID 1222555