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1H,3H-3a,7a:4,7-Dimethanoisobenzofuran-1,3-dione, 4,7-dihydro-8,8-diphenyl-, (3a.alpha.,4.alpha.,7.alpha.,7a.alpha.)-
SpectraBase Compound ID JUBpFUpMqZ3
InChI InChI=1S/C22H16O3/c23-18-21-16-11-12-17(13-16)22(21,19(24)25-18)20(21,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-12,16-17H,13H2/t16-,17+,21+,22-
InChIKey LCGIXMYMOSRZJY-UWSKWSKGSA-N
Mol Weight 328.37 g/mol
Molecular Formula C22H16O3
Exact Mass 328.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9O35rHPvRA0
Name 1H,3H-3a,7a:4,7-Dimethanoisobenzofuran-1,3-dione, 4,7-dihydro-8,8-diphenyl-, (3a.alpha.,4.alpha.,7.alpha.,7a.alpha.)-
Alternate Name(s) (1R,2R,5S,6S)-10,10-diphenyl-8-oxatetracyclo[4.3.1.1(2,5).0(1,6)]undec-3-ene-7,9-dione 3,3-Diphenyltricyclo[3.2.1.0(2,4)]oct-6-ene-endo,cis-2,4-dicarboxylic anhydride
CAS Registry Number 128608-83-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16O3
InChI InChI=1S/C22H16O3/c23-18-21-16-11-12-17(13-16)22(21,19(24)25-18)20(21,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-12,16-17H,13H2/t16-,17+,21+,22-
InChIKey LCGIXMYMOSRZJY-UWSKWSKGSA-N
Molecular Weight 328.367 g/mol
SMILES [C@]123[C@](C(=O)OC3=O)([C@@]3([H])C[C@@]1(C=C3)[H])C2(c1ccccc1)c1ccccc1
SPLASH splash10-03y0-0391000000-5f49c6692fe21d9f1bc2
Source of Spectrum B-43-557-9
Wiley ID 1326727