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6-Ethyl 1-Methyl (2Z,4E)-3-pentylhexa-2,4-diendioate
SpectraBase Compound ID 7yZn78MD96z
InChI InChI=1S/C14H22O4/c1-4-6-7-8-12(11-14(16)17-3)9-10-13(15)18-5-2/h9-11H,4-8H2,1-3H3/b10-9+,12-11-
InChIKey XVMDQGWXKYVZNN-PVHUKWJHSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7VTeKq3ZyVe
Name 6-Ethyl 1-Methyl (2Z,4E)-3-pentylhexa-2,4-diendioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-4-6-7-8-12(11-14(16)17-3)9-10-13(15)18-5-2/h9-11H,4-8H2,1-3H3/b10-9+,12-11-
InChIKey XVMDQGWXKYVZNN-PVHUKWJHSA-N
Molecular Weight 254.326 g/mol
SMILES C(\C=C/(\C=C\C(=O)OCC)CCCCC)(=O)OC
SPLASH splash10-001i-0900000000-bd158d42ceacf583c208
Source of Spectrum F4-0-2170-4
Synonyms 6-Ethyl 1-methyl (2Z,4E)-3-pentyl-2,4-hexadienedioate
Wiley ID 1620137