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

*Links on SpectraBase are not permalinks.

(1aR,3aR,4R,5S,7aR,7bS)-4,5,7a,7b-tetramethyl-4-[2-(5-oxo-2H-furan-4-yl)ethyl]-1a,2,3,3a,5,7-hexahydronaphtho[1,2-b]oxiren-6-one

View entire compound with spectra: 1 MS (GC)

(1aR,3aR,4R,5S,7aR,7bS)-4,5,7a,7b-tetramethyl-4-[2-(5-oxo-2H-furan-4-yl)ethyl]-1a,2,3,3a,5,7-hexahydronaphtho[1,2-b]oxiren-6-one
SpectraBase Compound ID AzO4bL2Sc34
InChI InChI=1S/C20H28O4/c1-12-14(21)11-19(3)15(5-6-16-20(19,4)24-16)18(12,2)9-7-13-8-10-23-17(13)22/h8,12,15-16H,5-7,9-11H2,1-4H3/t12-,15-,16-,18+,19-,20-/m1/s1
InChIKey BFUCGDUEEJSKJM-GATDGBPASA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 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 8KzYrneDAkv
Name (1aR,3aR,4R,5S,7aR,7bS)-4,5,7a,7b-tetramethyl-4-[2-(5-oxo-2H-furan-4-yl)ethyl]-1a,2,3,3a,5,7-hexahydronaphtho[1,2-b]oxiren-6-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-12-14(21)11-19(3)15(5-6-16-20(19,4)24-16)18(12,2)9-7-13-8-10-23-17(13)22/h8,12,15-16H,5-7,9-11H2,1-4H3/t12-,15-,16-,18+,19-,20-/m1/s1
InChIKey BFUCGDUEEJSKJM-GATDGBPASA-N
Ionization Type EI
Molecular Weight 332.440 g/mol
Optical Rotation [a]D14.9 = -46.5 (c = 0.09, MeOH)
Reported Formula C20H28O4
SMILES C1C[C@]2([C@@](CC([C@]([C@@]2(CCC=2C(OCC2)=O)C)(C)[H])=O)([C@]2([C@@]1(O2)[H])C)C)[H]
SPLASH splash10-0ac0-9000000000-544ab783e91ff5ee7b80
Source of Spectrum CN103923076B
Wiley ID 1850763