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2-OXABICYCLO[4.2.0]OCT-4-EN-3-ONE, REL-(1R,6S,7S,8S)-5-METHOXY-(4-METHOXY-2-OXO-2H-PYRAN-6-YL)-7-(4-ETHYLPHENYL)-1-[(E)-2-(4-ETHYLPHENYL
SpectraBase Compound ID HGS8IcmKHdA
InChI InChI=1S/C26H28O3.C6H6O3/c1-4-18-6-8-20(9-7-18)14-15-26-17-22(21-12-10-19(5-2)11-13-21)25(26)23(28-3)16-24(27)29-26;1-8-5-2-3-9-6(7)4-5/h6-16,22,25H,4-5,17H2,1-3H3;2-4H,1H3/b15-14+;
InChIKey LIPYCRNZOUIAPO-WPDLWGESSA-N
Mol Weight 514.62 g/mol
Molecular Formula C32H34O6
Exact Mass 514.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKv2pEObxox
Name 2-OXABICYCLO[4.2.0]OCT-4-EN-3-ONE, REL-(1R,6S,7S,8S)-5-METHOXY-(4-METHOXY-2-OXO-2H-PYRAN-6-YL)-7-(4-ETHYLPHENYL)-1-[(E)-2-(4-ETHYLPHENYL
Alternate Name(s) 2-OXABICYCLO[4.2.0]OCT-4-EN-3-ONE, REL-(1R,6S,7S,8S)-5-METHOXY-(4-METHOXY-2-OXO-2H-PYRAN-6-YL)-7-(4-ETHYLPHENYL)-1-[(E)-2-(4-ETHYLPHENYL)ETHENYL]-
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Formula C32H32O6
InChI InChI=1S/C26H28O3.C6H6O3/c1-4-18-6-8-20(9-7-18)14-15-26-17-22(21-12-10-19(5-2)11-13-21)25(26)23(28-3)16-24(27)29-26;1-8-5-2-3-9-6(7)4-5/h6-16,22,25H,4-5,17H2,1-3H3;2-4H,1H3/b15-14+;
InChIKey LIPYCRNZOUIAPO-WPDLWGESSA-N
Instrument Name 311A
Molecular Weight 514.2346
SMILES C=1OC(=O)C=C(OC)C1.C1(=O)C=C(OC)C2C(\C=C\c3ccc(CC)cc3)(O1)CC2c1ccc(CC)cc1
SPLASH splash10-0a4i-4980000000-7b2901d97cf4a0ae8d2f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany