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5,10-(Epoxymethano)-5H-dibenzo[a,d]cycloheptene-11-carboxylic acid, 10,11-dihydro-12-oxo-, [5S-(5.alpha.,10.alpha.,11.beta.)]-
SpectraBase Compound ID 4EKEDEZi58f
InChI InChI=1S/C17H12O4/c18-16(19)13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14(13)17(20)21-15/h1-8,13-15H,(H,18,19)/t13-,14+,15+/m0/s1
InChIKey GBENVBCUKWCHPK-RRFJBIMHSA-N
Mol Weight 280.28 g/mol
Molecular Formula C17H12O4
Exact Mass 280.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OgLMpC64WF
Name 5,10-(Epoxymethano)-5H-dibenzo[a,d]cycloheptene-11-carboxylic acid, 10,11-dihydro-12-oxo-, [5S-(5.alpha.,10.alpha.,11.beta.)]-
CAS Registry Number 115474-77-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O4
InChI InChI=1S/C17H12O4/c18-16(19)13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14(13)17(20)21-15/h1-8,13-15H,(H,18,19)/t13-,14+,15+/m0/s1
InChIKey GBENVBCUKWCHPK-RRFJBIMHSA-N
Molecular Weight 280.279 g/mol
SMILES OC([C@@]1([C@@]2(C(O[C@@](c3ccccc23)(c2ccccc12)[H])=O)[H])[H])=O
SPLASH splash10-0006-0930000000-7117b8ec5e0c69dcb234
Source of Spectrum F-43-4961-50
Synonyms (1R,8R,9R)-17-oxo-16-oxatetracyclo[7.6.2.0(2,7).0(10,15)]heptadeca-2,4,6,10,12,14-hexaene-8-carboxylic acid (5S,10R,11R)-12-oxo-5,10-oxaethano-10,11-dihydro-5H-dibenzo[a,d]cycloheptene-11-carboxylic acid
Wiley ID 1284068