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1,2-Benzenedicarboxylic acid, mono(10,11-dihydro-5,10-(epoxymethano)-5H-dibenzo[a,d]cyclohepten-11-yl) ester, [5R-(5.alpha.,10.alpha.,11.alpha.)]-
SpectraBase Compound ID AWSrOmsPLPw
InChI InChI=1S/C24H18O5/c25-23(26)18-11-5-6-12-19(18)24(27)29-22-17-10-4-3-9-16(17)21-15-8-2-1-7-14(15)20(22)13-28-21/h1-12,20-22H,13H2,(H,25,26)/t20-,21+,22-/m0/s1
InChIKey JBLOIENRRFMIFR-BDTNDASRSA-N
Mol Weight 386.4 g/mol
Molecular Formula C24H18O5
Exact Mass 386.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID igPGXAtWnr
Name 1,2-Benzenedicarboxylic acid, mono(10,11-dihydro-5,10-(epoxymethano)-5H-dibenzo[a,d]cyclohepten-11-yl) ester, [5R-(5.alpha.,10.alpha.,11.alpha.)]-
CAS Registry Number 115511-41-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18O5
InChI InChI=1S/C24H18O5/c25-23(26)18-11-5-6-12-19(18)24(27)29-22-17-10-4-3-9-16(17)21-15-8-2-1-7-14(15)20(22)13-28-21/h1-12,20-22H,13H2,(H,25,26)/t20-,21+,22-/m0/s1
InChIKey JBLOIENRRFMIFR-BDTNDASRSA-N
Molecular Weight 386.403 g/mol
SMILES OC(c1c(C(O[C@@]2([C@@]3(c4c(cccc4)[C@](c4c2cccc4)(OC3)[H])[H])[H])=O)cccc1)=O
SPLASH splash10-052o-0890000000-e37f096a8342c8f11bf1
Source of Spectrum F-43-4965-66
Synonyms 5,10-(Epoxymethano)-5H-dibenzo[a,d]cycloheptene, 1,2-benzenedicarboxylic acid deriv. (5R,10R,11R)-11-hemiphthalate-10,11-dihydro-5H-5,10-oxaethano-dibenzo[a,d]cycloheptene 2-{[(1R,8R,9R)-16-oxatetracyclo[7.6.2.0(2,7).0(10,15)]heptadeca-2,4,6,10,12,14-hexaen-8-yloxy]carbonyl}benzoic acid
Wiley ID 1362827