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(3S,3aS,9bR)-8-methoxy-3,6,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g]benzofuran-2-one
SpectraBase Compound ID Kf7QYHi5inY
InChI InChI=1S/C16H20O3/c1-8-7-13(18-4)10(3)14-11(8)5-6-12-9(2)16(17)19-15(12)14/h7,9,12,15H,5-6H2,1-4H3/t9-,12-,15+/m0/s1
InChIKey GNCNKCJJKNUKGL-ONENECBXSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9XkMKEGg3ii
Name (3S,3aS,9bR)-8-methoxy-3,6,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g]benzofuran-2-one
CAS Registry Number 55057-88-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-8-7-13(18-4)10(3)14-11(8)5-6-12-9(2)16(17)19-15(12)14/h7,9,12,15H,5-6H2,1-4H3/t9-,12-,15+/m0/s1
InChIKey GNCNKCJJKNUKGL-ONENECBXSA-N
Molecular Weight 260.333 g/mol
SMILES [C@@]12(c3c(c(C)cc(c3C)OC)CC[C@]1([C@](C)(C(O2)=O)[H])[H])[H]
SPLASH splash10-000i-0940000000-765e377574bb5462e2b3
Source of Spectrum T-67-3356-0
Synonyms (3S,3aS,9bR)-8-methoxy-3,6,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g][1]benzofuran-2-one
Wiley ID 1263977