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

*Links on SpectraBase are not permalinks.
2,4a,5,6,8,8a-Hexahydro-4a-hydroxy-5,5,8a-trimethyl-7H-[1]benzopyran-7-one
SpectraBase Compound ID BisjVjt2MDR
InChI InChI=1S/C12H18O3/c1-10(2)7-9(13)8-11(3)12(10,14)5-4-6-15-11/h4-5,14H,6-8H2,1-3H3/t11-,12-/m1/s1
InChIKey FQSCJAFPUPDWII-VXGBXAGGSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 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 Hy0vU3L7Kd3
Name 2,4a,5,6,8,8a-Hexahydro-4a-hydroxy-5,5,8a-trimethyl-7H-[1]benzopyran-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-10(2)7-9(13)8-11(3)12(10,14)5-4-6-15-11/h4-5,14H,6-8H2,1-3H3/t11-,12-/m1/s1
InChIKey FQSCJAFPUPDWII-VXGBXAGGSA-N
Molecular Weight 210.273 g/mol
SMILES O[C@]12[C@@](CC(CC2(C)C)=O)(OCC=C1)C
SPLASH splash10-03xr-5900000000-f350445ff0f7995ae855
Source of Spectrum U-1994-421-19
Synonyms (4aR,8aR)-4a-Hydroxy-5,5,8a-trimethyl-2,4a,5,6,8,8a-hexahydro-chromen-7-one 4a-hydroxy-5,5,8a-trimethyl-2,4a,5,6,8,8a-hexahydro-7H-chromen-7-one
Wiley ID 765839