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Dimethyl 1-(5'-isopropyl-8'-methylazulen-1'-yl)ethene-1,2-dicarboxylate
SpectraBase Compound ID 2NNjxwfBNH8
InChI InChI=1S/C20H22O4/c1-12(2)14-7-6-13(3)19-15(10-14)8-9-16(19)17(20(22)24-5)11-18(21)23-4/h6-12H,1-5H3/b17-11+
InChIKey HQCKJZJVYDTFIJ-GZTJUZNOSA-N
Mol Weight 326.39 g/mol
Molecular Formula C20H22O4
Exact Mass 326.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHEcdjA3vr9
Name Dimethyl 1-(5'-isopropyl-8'-methylazulen-1'-yl)ethene-1,2-dicarboxylate
Alternate Name(s) Dimethyl (2E)-2-(5-isopropyl-8-methyl-1-azulenyl)-2-butenedioate
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Formula C20H22O4
InChI InChI=1S/C20H22O4/c1-12(2)14-7-6-13(3)19-15(10-14)8-9-16(19)17(20(22)24-5)11-18(21)23-4/h6-12H,1-5H3/b17-11+
InChIKey HQCKJZJVYDTFIJ-GZTJUZNOSA-N
Molecular Weight 326.392 g/mol
SMILES c1(c2c(cc(C(C)C)ccc2C)cc1)\C(=C/C(=O)OC)C(=O)OC
SPLASH splash10-05r0-4924000000-d753f70601fbf8657b83
Source of Spectrum H-78-1414-14
Wiley ID 1324978