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Dimethyl (3Z,6E)-5,5-dimethyl-3,6-nonadienedioate

View entire compound with spectra: 3 MS (GC)

Dimethyl (3Z,6E)-5,5-dimethyl-3,6-nonadienedioate
SpectraBase Compound ID CstopvIRgxB
InChI InChI=1S/C13H20O4/c1-13(2,9-5-7-11(14)16-3)10-6-8-12(15)17-4/h5-6,9-10H,7-8H2,1-4H3/b9-5-,10-6+
InChIKey OBTCZDWEYGBWIG-VTBWALSUSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwXbavlLtZM
Name Dimethyl (3Z,6E)-5,5-dimethyl-3,6-nonadienedioate
Alternate Name(s) (3Z,6E)-5,5-dimethylnona-3,6-dienedioic acid dimethyl ester 3,6-Nonadienedioic acid, 5,5-dimethyl-, dimethyl ester Dimethyl (3Z,6E)-5,5-dimethylnona-3,6-dienedioate
CAS Registry Number 103620-11-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-13(2,9-5-7-11(14)16-3)10-6-8-12(15)17-4/h5-6,9-10H,7-8H2,1-4H3/b9-5-,10-6+
InChIKey OBTCZDWEYGBWIG-VTBWALSUSA-N
Molecular Weight 240.299 g/mol
SMILES COC(=O)C\C=C/C(C)(C)\C=C\CC(=O)OC
SPLASH splash10-0a4i-2900000000-b5a5510b36b8d053f4a5
Source of Spectrum K-119-3100-12
Wiley ID 1242870