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2-OXABICYCLO[4.2.0]OCT-4-EN-3-ONE, REL-(1R,6S,7R,8R)-5-METHOXY-8-(4-METHOXY-2-OXO-2H-PYRAN-6-YL)-7-(2-ACETOXYPHENYL)-1-[(E)-2-(2-ACET
SpectraBase Compound ID 1wLJCGgtfka
InChI InChI=1S/C26H24O7.C6H6O3/c1-16(27)31-21-10-6-4-8-18(21)12-13-26-15-20(25(26)23(30-3)14-24(29)33-26)19-9-5-7-11-22(19)32-17(2)28;1-8-5-2-3-9-6(7)4-5/h4-14,20,25H,15H2,1-3H3;2-4H,1H3/b13-12+;
InChIKey TUKMQCOHOBMLAR-UEIGIMKUSA-N
Mol Weight 574.58 g/mol
Molecular Formula C32H30O10
Exact Mass 574.183897 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I9wGoSYPCAj
Name 2-OXABICYCLO[4.2.0]OCT-4-EN-3-ONE, REL-(1R,6S,7S,8S)-5-METHOXY-8-(4-METHOXY-2-OXO-2H-PYRAN-6-YL)-7-(2-ACETOXYPHENYL)-1-[(E)-2-(2-ACET
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C32H28O10
InChI InChI=1S/C26H24O7.C6H6O3/c1-16(27)31-21-10-6-4-8-18(21)12-13-26-15-20(25(26)23(30-3)14-24(29)33-26)19-9-5-7-11-22(19)32-17(2)28;1-8-5-2-3-9-6(7)4-5/h4-14,20,25H,15H2,1-3H3;2-4H,1H3/b13-12+;
InChIKey TUKMQCOHOBMLAR-UEIGIMKUSA-N
Instrument Name 311A
Molecular Weight 574.1830
SMILES C=1OC(=O)C=C(OC)C1.C1(=O)C=C(OC)C2C(\C=C\c3c(OC(=O)C)cccc3)(O1)CC2c1c(OC(=O)C)cccc1
SPLASH splash10-0006-6890000000-2253ff1e794422e134cc
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany