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1,8-Dimethyltetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13,15-heptaene-15,16-dicarboxylic acid
SpectraBase Compound ID KqXLWE9cuNL
InChI InChI=1S/C20H16O4/c1-19-11-7-3-5-9-13(11)20(2,14-10-6-4-8-12(14)19)16(18(23)24)15(19)17(21)22/h3-10H,1-2H3,(H,21,22)(H,23,24)/t19-,20+
InChIKey AVQWZPACFRZUSJ-BGYRXZFFSA-N
Mol Weight 320.34 g/mol
Molecular Formula C20H16O4
Exact Mass 320.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C2PlimMg9sF
Name 1,8-Dimethyltetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13,15-heptaene-15,16-dicarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16O4
InChI InChI=1S/C20H16O4/c1-19-11-7-3-5-9-13(11)20(2,14-10-6-4-8-12(14)19)16(18(23)24)15(19)17(21)22/h3-10H,1-2H3,(H,21,22)(H,23,24)/t19-,20+
InChIKey AVQWZPACFRZUSJ-BGYRXZFFSA-N
Molecular Weight 320.344 g/mol
SMILES OC(C=1[C@@]2(c3c([C@](C1C(=O)O)(c1c2cccc1)C)cccc3)C)=O
SPLASH splash10-069r-1390000000-a5c73cfba2e3830f93c7
Wiley ID 1474482