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Tricyclo[9.3.1.1(4,8)]hexadeca-1(15),4,6,8(16),11,13-hexaene-5,12-dicarboxylic acid, dimethyl ester
SpectraBase Compound ID HGaz4xbm0Sw
InChI InChI=1S/C20H20O4/c1-23-19(21)17-9-5-13-4-8-16-12-14(3-7-15(17)11-13)6-10-18(16)20(22)24-2/h5-6,9-12H,3-4,7-8H2,1-2H3
InChIKey XQFRACFYIIQQSH-UHFFFAOYSA-N
Mol Weight 324.38 g/mol
Molecular Formula C20H20O4
Exact Mass 324.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ueWTQu6ENG
Name Tricyclo[9.3.1.1(4,8)]hexadeca-1(15),4,6,8(16),11,13-hexaene-5,12-dicarboxylic acid, dimethyl ester
CAS Registry Number 55705-34-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O4
InChI InChI=1S/C20H20O4/c1-23-19(21)17-9-5-13-4-8-16-12-14(3-7-15(17)11-13)6-10-18(16)20(22)24-2/h5-6,9-12H,3-4,7-8H2,1-2H3
InChIKey XQFRACFYIIQQSH-UHFFFAOYSA-N
Molecular Weight 324.376 g/mol
SMILES c1(c2cc(cc1)CCc1c(C(=O)OC)ccc(c1)CC2)C(=O)OC
SPLASH splash10-0avi-0192000000-8798b4a29124a0de1fa9
Source of Spectrum AH-106-771-0
Synonyms Dimethyl tricyclo[9.3.1.1(4,8)]hexadeca-1(15),4(16),5,7,11,13-hexaene-5,12-dicarboxylate Dimethylester of[2.2]metacyclophane-4,12-dicarboxylic acid
Wiley ID 1323419