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(4aS*,7S*,8R*,8aR*)-8-Benzoyl-6,7-dimethyl-3,4,4a,7,8,8ahexahydro-1H-isochromene-1-one
SpectraBase Compound ID Ifs6EDrl09X
InChI InChI=1S/C18H20O3/c1-11-10-14-8-9-21-18(20)16(14)15(12(11)2)17(19)13-6-4-3-5-7-13/h3-7,10,12,14-16H,8-9H2,1-2H3/t12-,14+,15-,16-/m1/s1
InChIKey UDZCLEDDJZEDDY-SLBVQIDZSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9AowQLzw0Hq
Name (4aS*,7S*,8R*,8aR*)-8-Benzoyl-6,7-dimethyl-3,4,4a,7,8,8ahexahydro-1H-isochromene-1-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O3
InChI InChI=1S/C18H20O3/c1-11-10-14-8-9-21-18(20)16(14)15(12(11)2)17(19)13-6-4-3-5-7-13/h3-7,10,12,14-16H,8-9H2,1-2H3/t12-,14+,15-,16-/m1/s1
InChIKey UDZCLEDDJZEDDY-SLBVQIDZSA-N
Molecular Weight 284.355 g/mol
SMILES [C@]1([C@]2([C@](CCOC2=O)([H])C=C([C@]1(C)[H])C)[H])(C(=O)c1ccccc1)[H]
SPLASH splash10-0a6r-3910000000-c57c3ef4b87fbc02796a
Source of Spectrum F-67-191-24g
Wiley ID 1685342