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3-Nonylisoxazole-5-carboxylic acid methyl ester
SpectraBase Compound ID 6gAKyVefNNy
InChI InChI=1S/C14H23NO3/c1-3-4-5-6-7-8-9-10-12-11-13(18-15-12)14(16)17-2/h11H,3-10H2,1-2H3
InChIKey KHGSELADISSZLN-UHFFFAOYSA-N
Mol Weight 253.34 g/mol
Molecular Formula C14H23NO3
Exact Mass 253.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EX04xsynUIa
Name 3-Nonylisoxazole-5-carboxylic acid methyl ester
Alternate Name(s) 3-nonyl-5-isoxazolecarboxylic acid methyl ester Methyl 3-nonylisoxazole-5-carboxylate
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Formula C14H23NO3
InChI InChI=1S/C14H23NO3/c1-3-4-5-6-7-8-9-10-12-11-13(18-15-12)14(16)17-2/h11H,3-10H2,1-2H3
InChIKey KHGSELADISSZLN-UHFFFAOYSA-N
Molecular Weight 253.342 g/mol
SMILES c1(noc(c1)C(=O)OC)CCCCCCCCC
SPLASH splash10-0006-1910000000-0031bfda4fb191e953d0
Source of Spectrum K-2002-2036-4
Wiley ID 1581433