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(1S,2S)-1-Acetic acid 2-(hexa-1'E,3'Z,5'-trienyl)cyclopropylmethyl ester
SpectraBase Compound ID oTWh9yehb3
InChI InChI=1S/C12H16O2/c1-3-4-5-6-7-11-8-12(11)9-14-10(2)13/h3-7,11-12H,1,8-9H2,2H3/b5-4-,7-6+/t11-,12-/m1/s1
InChIKey KCPQPDLACUVAJP-SIIJYTMRSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bMt0vdqSS0
Name (1S,2S)-1-Acetic acid 2-(hexa-1'E,3'Z,5'-trienyl)cyclopropylmethyl ester
Alternate Name(s) [(1S,2S)-2-[(1E,3Z)-hexa-1,3,5-trienyl]cyclopropyl]methyl acetate [(1S,2S)-2-[(1E,3Z)-hexa-1,3,5-trienyl]cyclopropyl]methyl ethanoate
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Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-3-4-5-6-7-11-8-12(11)9-14-10(2)13/h3-7,11-12H,1,8-9H2,2H3/b5-4-,7-6+/t11-,12-/m1/s1
InChIKey KCPQPDLACUVAJP-SIIJYTMRSA-N
Molecular Weight 192.258 g/mol
SMILES [C@]1([C@@](COC(=O)C)(C1)[H])(\C=C\C=C/C=C)[H]
SPLASH splash10-00kf-9600000000-c89457b5e46f29b124d4
Source of Spectrum F-53-13692-23
Wiley ID 803865