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1-Undecen-2,3-dicarboxylic acid

View entire compound with spectra: 1 MS (GC)

1-Undecen-2,3-dicarboxylic acid
SpectraBase Compound ID 2W9QZyAfdhg
InChI InChI=1S/C13H22O4/c1-3-4-5-6-7-8-9-11(13(16)17)10(2)12(14)15/h11H,2-9H2,1H3,(H,14,15)(H,16,17)
InChIKey KXSQPJOPEPZWIA-UHFFFAOYSA-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 LATRTS3xFvW
Name 1-Undecen-2,3-dicarboxylic acid
Alternate Name(s) 2-Methylene-3-octylbutanedioic acid 2-Methylidene-3-octylbutanedioic acid 2-Methylene-3-octyl-butanedioic acid 2-Methylidene-3-octyl-butanedioic acid
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Formula C13H22O4
InChI InChI=1S/C13H22O4/c1-3-4-5-6-7-8-9-11(13(16)17)10(2)12(14)15/h11H,2-9H2,1H3,(H,14,15)(H,16,17)
InChIKey KXSQPJOPEPZWIA-UHFFFAOYSA-N
Molecular Weight 242.315 g/mol
SMILES OC(C(C(C(=O)O)CCCCCCCC)=C)=O
SPLASH splash10-08i1-9800000000-54d86b4f31c8dfa4d0c6
Source of Spectrum F-59-2994-12b
Wiley ID 1677863