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(3aR,7aS)-3a,7,7-trimethyl-3-phenyl-6,7a-dihydro-4H-indene-1,5-dione
SpectraBase Compound ID IonkVDOkYlD
InChI InChI=1S/C18H20O2/c1-17(2)10-13(19)11-18(3)14(9-15(20)16(17)18)12-7-5-4-6-8-12/h4-9,16H,10-11H2,1-3H3/t16-,18-/m0/s1
InChIKey PUCKEEONKNFAOC-WMZOPIPTSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2NcnZwfE2K
Name (3aR,7aS)-3a,7,7-trimethyl-3-phenyl-6,7a-dihydro-4H-indene-1,5-dione
Alternate Name(s) (3aR,7aS)-3a,7,7-trimethyl-3-phenyl-6,7a-dihydro-4H-indene-1,5-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-17(2)10-13(19)11-18(3)14(9-15(20)16(17)18)12-7-5-4-6-8-12/h4-9,16H,10-11H2,1-3H3/t16-,18-/m0/s1
InChIKey PUCKEEONKNFAOC-WMZOPIPTSA-N
Molecular Weight 268.356 g/mol
SMILES [C@]12(C(=CC([C@]2(C(C)(C)CC(C1)=O)[H])=O)c1ccccc1)C
SPLASH splash10-005c-2930000000-99c9e56a4d4aeea149a1
Source of Spectrum J-63-9444-6
Wiley ID 1272693