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2-Acetoxy-3,4-(isopropylidenedioxy)undec-5-en-1-al
SpectraBase Compound ID KaId5dW5BnT
InChI InChI=1S/C16H26O5/c1-5-6-7-8-9-10-13-15(21-16(3,4)20-13)14(11-17)19-12(2)18/h9-11,13-15H,5-8H2,1-4H3/b10-9-/t13-,14-,15-/m1/s1
InChIKey SYMOPONOPUWZEB-IXIWNONGSA-N
Mol Weight 298.38 g/mol
Molecular Formula C16H26O5
Exact Mass 298.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fHA66Pkuzw
Name 2-Acetoxy-3,4-(isopropylidenedioxy)undec-5-en-1-al
Alternate Name(s) 1-{5-[(1Z)-1-heptenyl]-2,2-dimethyl-1,3-dioxolan-4-yl}-2-oxoethyl acetate Acetic acid (S)-1-[(4R,5R)-5-((Z)-hept-1-enyl)-2,2-dimethyl-[1,3]dioxolan-4-yl]-2-oxo-ethyl ester
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Formula C16H26O5
InChI InChI=1S/C16H26O5/c1-5-6-7-8-9-10-13-15(21-16(3,4)20-13)14(11-17)19-12(2)18/h9-11,13-15H,5-8H2,1-4H3/b10-9-/t13-,14-,15-/m1/s1
InChIKey SYMOPONOPUWZEB-IXIWNONGSA-N
Molecular Weight 298.379 g/mol
SMILES [C@@]1(OC(C)(C)O[C@@]1(\C=C/CCCCC)[H])([C@](OC(=O)C)(C=O)[H])[H]
SPLASH splash10-0006-0090000000-bba5fd17c9ec855b965c
Source of Spectrum J-58-3588-5
Wiley ID 1300894