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Dimethyl (Z)-2-hexyl-3-methyl-2-buten-1,4-dioate
SpectraBase Compound ID GJsWDAvPKsV
InChI InChI=1S/C13H22O4/c1-5-6-7-8-9-11(13(15)17-4)10(2)12(14)16-3/h5-9H2,1-4H3/b11-10-
InChIKey SBJHHFISYOOZLE-KHPPLWFESA-N
Mol Weight 242.31 g/mol
Molecular Formula C13H22O4
Exact Mass 242.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pTR4zjx4gE
Name Dimethyl (Z)-2-hexyl-3-methyl-2-buten-1,4-dioate
Classification Fatty acid esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 242.151809184 u
Formula C13H22O4
InChI InChI=1S/C13H22O4/c1-5-6-7-8-9-11(13(15)17-4)10(2)12(14)16-3/h5-9H2,1-4H3/b11-10-
InChIKey SBJHHFISYOOZLE-KHPPLWFESA-N
Molecular Weight 242.315 g/mol
Number of Peaks 19
SMILES C(\C(=C\(CCCCCC)C(OC)=O)C)(=O)OC
SPLASH splash10-01r6-3920000000-8c41943629c85edaedde
Source of Spectrum FF-13-307-M24 (DOI: 10.1002_(SICI)1099-1026(1998090)13_5_295)
Synonyms Dimethyl 2-hexyl-3-methylmaleate (Z)-2-hexyl-3-methyl-2-butenedioic acid dimethyl ester Dimethyl (Z)-2-hexyl-3-methylbut-2-enedioate Dimethyl (Z)-2-hexyl-3-methyl-but-2-enedioate
Wiley ID 1775217