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5-OXO-1,2-DIPHENYL-3,7-DIOXA-TRICYCLO-[4.1.0.0-(0,4)]-HEPTANE-4,6-DICARBOXYLIC-ACID-DIMETHYLESTER
SpectraBase Compound ID 3zC6vbLiE24
InChI InChI=1S/C21H16O7/c1-25-16(23)18-15(22)19(17(24)26-2)21(28-19,14-11-7-4-8-12-14)20(18,27-18)13-9-5-3-6-10-13/h3-12H,1-2H3/t18-,19+,20+,21-
InChIKey NEGIPAZPDBLPOS-UJOPUZHASA-N
Mol Weight 380.35 g/mol
Molecular Formula C21H16O7
Exact Mass 380.089603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9tJdjPjCTBV
Name 5-OXO-1,2-DIPHENYL-3,7-DIOXA-TRICYCLO-[4.1.0.0-(0,4)]-HEPTANE-4,6-DICARBOXYLIC-ACID-DIMETHYLESTER
Compound Number 1Z
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H16O7
InChI InChI=1S/C21H16O7/c1-25-16(23)18-15(22)19(17(24)26-2)21(28-19,14-11-7-4-8-12-14)20(18,27-18)13-9-5-3-6-10-13/h3-12H,1-2H3/t18-,19+,20+,21-
InChIKey NEGIPAZPDBLPOS-UJOPUZHASA-N
Literature Reference Author Y.YOSHITAKE,K.YAMAGUCHI,C.KAI,T.AKIYAMA,C.HANDA,T.JIKYO,K.HA RANO
Literature Reference Citation J.ORG.CHEM.,66,8902(2001)
Literature Reference DOI 10.1021/jo015941o
Molecular Weight 380.354 g/mol
Solvent CDCl3
Source File Reference UWVN26575