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(3aR,5aR,7R,9aS,9bR)-3a,6,6,9a-tetramethyl-7-oxidanyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e][1]benzofuran-2-one
SpectraBase Compound ID 48OHywSMI5I
InChI InChI=1S/C16H26O3/c1-14(2)10-5-8-16(4)11(9-13(18)19-16)15(10,3)7-6-12(14)17/h10-12,17H,5-9H2,1-4H3/t10-,11+,12+,15-,16+/m0/s1
InChIKey TXENFVISCXJJMT-DAEOAZLPSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSefjS1v0Pf
Name (3aR,5aR,7R,9aS,9bR)-3a,6,6,9a-tetramethyl-7-oxidanyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e][1]benzofuran-2-one
CAS Registry Number 123844-63-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-14(2)10-5-8-16(4)11(9-13(18)19-16)15(10,3)7-6-12(14)17/h10-12,17H,5-9H2,1-4H3/t10-,11+,12+,15-,16+/m0/s1
InChIKey TXENFVISCXJJMT-DAEOAZLPSA-N
Molecular Weight 266.381 g/mol
SMILES O[C@@]1(CC[C@]2([C@](C1(C)C)(CC[C@@]1([C@@]2(CC(=O)O1)[H])C)[H])C)[H]
SPLASH splash10-0002-0920000000-293a44072336f2b5d999
Source of Spectrum F-45-3581-1
Synonyms (3aR,5aR,7R,9aS,9bR)-7-hydroxy-3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e]benzofuran-2-one (3aR,5aR,7R,9aS,9bR)-7-hydroxy-3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e][1]benzofuran-2-one
Wiley ID 1270363