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1,11-Methanobenzo[1,2:4,5]dicycloheptene-6,13-dicarboxylic acid, 6,11a,12,12a-tetrahydro-, dimethyl ester
SpectraBase Compound ID J4eWq7Gnv2t
InChI InChI=1S/C21H20O4/c1-24-20(22)18-12-7-3-5-9-14-16(12)11-17-13(18)8-4-6-10-15(17)19(14)21(23)25-2/h3-10,16-19H,11H2,1-2H3
InChIKey BOOODYAKXGPYFZ-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C21H20O4
Exact Mass 336.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4VaFc9ZG82u
Name 1,11-Methanobenzo[1,2:4,5]dicycloheptene-6,13-dicarboxylic acid, 6,11a,12,12a-tetrahydro-, dimethyl ester
CAS Registry Number 109123-95-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O4
InChI InChI=1S/C21H20O4/c1-24-20(22)18-12-7-3-5-9-14-16(12)11-17-13(18)8-4-6-10-15(17)19(14)21(23)25-2/h3-10,16-19H,11H2,1-2H3
InChIKey BOOODYAKXGPYFZ-UHFFFAOYSA-N
Molecular Weight 336.387 g/mol
SMILES C=12C3C(C(C(=O)OC)C=4C(C(C2C(=O)OC)=CC=CC4)C3)=CC=CC1
SPLASH splash10-0udi-0094000000-8f23e14dc77b9f191814
Source of Spectrum C-109-5002-22
Synonyms 7,14-Dicarbomethoxy-7,14-dihydro-1,6 7,14-Dicarbomethoxy-7,14-dihydro-1,6;8,13-propanediylidene[14]annulene 8,13-Propanediylidene[14]annulene Dimethyl tetracyclo[11.3.1.0(6,16).0(8,14)]heptadeca-1,3,5,8,10,12-hexaene-7,17-dicarboxylate
Wiley ID 1332619