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1-[(Benzoyloxy)methyl]-6-[(4'-phenylbutanoyl)oxymethyl]-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic Anhydride
SpectraBase Compound ID LLlYD3dhOFe
InChI InChI=1S/C27H26O8/c28-21(13-7-10-17-8-3-1-4-9-17)32-15-19-14-20-22-23(26(31)34-25(22)30)27(19,35-20)16-33-24(29)18-11-5-2-6-12-18/h1-6,8-9,11-12,19-20,22-23H,7,10,13-16H2
InChIKey VUTFVJBYJVZMLC-UHFFFAOYSA-N
Mol Weight 478.5 g/mol
Molecular Formula C27H26O8
Exact Mass 478.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hOzC2mSiUr
Name 1-[(Benzoyloxy)methyl]-6-[(4'-phenylbutanoyl)oxymethyl]-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic Anhydride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26O8
InChI InChI=1S/C27H26O8/c28-21(13-7-10-17-8-3-1-4-9-17)32-15-19-14-20-22-23(26(31)34-25(22)30)27(19,35-20)16-33-24(29)18-11-5-2-6-12-18/h1-6,8-9,11-12,19-20,22-23H,7,10,13-16H2
InChIKey VUTFVJBYJVZMLC-UHFFFAOYSA-N
Molecular Weight 478.497 g/mol
SMILES C12(C3C(OC(C3C(O1)CC2COC(=O)CCCc1ccccc1)=O)=O)COC(=O)c1ccccc1
SPLASH splash10-05r0-0904700000-671cbed629f32e752334
Source of Spectrum C-125-9748-12
Wiley ID 1701152