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1'(S)-Pentyl-4'-acetoxy-2(Z)-butenyl 2-Propynoate
SpectraBase Compound ID K2COZb5RzA9
InChI InChI=1S/C14H20O4/c1-4-6-7-9-13(18-14(16)5-2)10-8-11-17-12(3)15/h2,8,10,13H,4,6-7,9,11H2,1,3H3/b10-8-/t13-/m0/s1
InChIKey UISLYGKBPUCSCL-KJJQSCHISA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJI4se6YwYt
Name 1'(S)-Pentyl-4'-acetoxy-2(Z)-butenyl 2-Propynoate
Alternate Name(s) (1S,2Z)-4-(acetyloxy)-1-pentyl-2-butenyl propiolate 2-Propynoic acid[(Z,4S)-1-acetyloxynon-2-en-4-yl]ester Propiolic acid[(Z,1S)-4-acetoxy-1-amyl-but-2-enyl]ester [(1S)-1-[(Z)-3-acetoxyprop-1-enyl]hexyl]prop-2-ynoate [(Z,4S)-1-acetyloxynon-2-en-4-yl]prop-2-ynoate 2-Propynoic acid [(Z,4S)-1-acetyloxynon-2-en-4-yl] ester [(1S)-1-[(Z)-3-acetoxyprop-1-enyl]hexyl] prop-2-ynoate [(Z,4S)-1-acetyloxynon-2-en-4-yl] prop-2-ynoate
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Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-4-6-7-9-13(18-14(16)5-2)10-8-11-17-12(3)15/h2,8,10,13H,4,6-7,9,11H2,1,3H3/b10-8-/t13-/m0/s1
InChIKey UISLYGKBPUCSCL-KJJQSCHISA-N
Molecular Weight 252.310 g/mol
SMILES C(C(=O)O[C@](\C=C/COC(=O)C)(CCCCC)[H])#C
SPLASH splash10-0089-2900000000-f17678c5a8452628a3cf
Source of Spectrum J-60-1088-3
Wiley ID 1255625