Octanoic acid, 2-furanylmethyl ester

Formula: C₁₃H₂₀O₃
Molecular weight: 224.2961
IUPAC Standard InChI: InChI=1S/C13H20O3/c1-2-3-4-5-6-9-13(14)16-11-12-8-7-10-15-12/h7-8,10H,2-6,9,11H2,1H3
IUPAC Standard InChIKey: JNIWCVWKECYDSV-UHFFFAOYSA-N
CAS Registry Number: 39252-03-4
Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
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Other names: Furfuryl octanoate
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Gas Chromatography

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Column type	Active phase	I	Reference	Comment
Capillary	DB-1	1543.	Palá-Paúl, Velasco-Negueruela, et al., 2004	50. m/0.25 mm/0.25 μm, N2, 4. K/min; T_start: 95. C; T_end: 240. C

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Palá-Paúl, Velasco-Negueruela, et al., 2004
Palá-Paúl, J.; Velasco-Negueruela, A.; Pérez-Alonso, M.J.; Maqueda, J.; Sanz, J., Volatile oil constituents from different parts of Cachrys trifida L., J. Essent. Oil Res., 2004, 16, 4, 347-349, https://doi.org/10.1080/10412905.2004.9698738 . [all data]

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Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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