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5,6,8,10-tetramethylheptalene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID DSwBVWupSYM
InChI InChI=1S/C20H22O4/c1-11-7-12(2)17-14(4)9-15(19(21)23-5)10-16(20(22)24-6)18(17)13(3)8-11/h7-10H,1-6H3
InChIKey XQKBFCKUYAASIS-UHFFFAOYSA-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 A3udwDXMSy2
Name 5,6,8,10-tetramethylheptalene-1,3-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 5,6,8,10-tetramethylheptalene-1,3-dicarboxylate
CAS Registry Number 101391-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O4
InChI InChI=1S/C20H22O4/c1-11-7-12(2)17-14(4)9-15(19(21)23-5)10-16(20(22)24-6)18(17)13(3)8-11/h7-10H,1-6H3
InChIKey XQKBFCKUYAASIS-UHFFFAOYSA-N
Molecular Weight 326.392 g/mol
SMILES C12=C(C=C(C(=O)OC)C=C(C2=C(C=C(C=C1C)C)C)C)C(=O)OC
SPLASH splash10-004i-0392000000-052598aae6fcb0281b83
Source of Spectrum H-68-1022-5
Wiley ID 1324964