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(+-)-(2-.alpha.,3a-.beta.,7a-.alpha.)-Octahydro-4,4,7a-trimethyl-2-(4-oxa-5-oxocyclopentenyl)benzo[b]furan
SpectraBase Compound ID Bh6OzzXp7IF
InChI InChI=1S/C15H22O3/c1-14(2)6-4-7-15(3)12(14)9-11(18-15)10-5-8-17-13(10)16/h5,11-12H,4,6-9H2,1-3H3/t11-,12+,15+/m1/s1
InChIKey VSKRYJWPUYXJAU-XUJVJEKNSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lB5xif3YPS
Name (+-)-(2-.alpha.,3a-.beta.,7a-.alpha.)-Octahydro-4,4,7a-trimethyl-2-(4-oxa-5-oxocyclopentenyl)benzo[b]furan
CAS Registry Number 76215-68-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-14(2)6-4-7-15(3)12(14)9-11(18-15)10-5-8-17-13(10)16/h5,11-12H,4,6-9H2,1-3H3/t11-,12+,15+/m1/s1
InChIKey VSKRYJWPUYXJAU-XUJVJEKNSA-N
Molecular Weight 250.338 g/mol
SMILES C=1([C@@]2(O[C@]3(CCCC([C@@]3(C2)[H])(C)C)C)[H])C(OCC1)=O
SPLASH splash10-000i-3390000000-c1bbcd0e315600f2e831
Source of Spectrum J-46-1204-0
Synonyms 3-[(2R,3aS,7aS)-4,4,7a-trimethyloctahydro-1-benzofuran-2-yl]-2(5H)-furanone
Wiley ID 1253581