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4-Hydroxy-4-isopropyl-1,5,5-trimethyl-2-hexynyl acetate
SpectraBase Compound ID G04YmUcHIJk
InChI InChI=1S/C14H24O3/c1-10(2)14(16,13(5,6)7)9-8-11(3)17-12(4)15/h10-11,16H,1-7H3
InChIKey KJLHUHVCKAYKDN-UHFFFAOYSA-N
Mol Weight 240.34 g/mol
Molecular Formula C14H24O3
Exact Mass 240.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LRjdFuB0Nkd
Name 4-Hydroxy-4-isopropyl-1,5,5-trimethyl-2-hexynyl acetate
Alternate Name(s) (4-hydroxy-4-isopropyl-1,5,5-trimethyl-hex-2-ynyl) acetate (5-hydroxy-6,6-dimethyl-5-propan-2-ylhept-3-yn-2-yl) acetate (6,6-dimethyl-5-oxidanyl-5-propan-2-yl-hept-3-yn-2-yl) ethanoate Acetic acid (4-hydroxy-4-isopropyl-1,5,5-trimethyl-hex-2-ynyl) ester Acetic acid (5-hydroxy-6,6-dimethyl-5-propan-2-ylhept-3-yn-2-yl) ester Acetic acid, 4-t-butyl-4-hydroxy-1,5-dimethyl-hex-2-ynyl ester
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Formula C14H24O3
InChI InChI=1S/C14H24O3/c1-10(2)14(16,13(5,6)7)9-8-11(3)17-12(4)15/h10-11,16H,1-7H3
InChIKey KJLHUHVCKAYKDN-UHFFFAOYSA-N
Molecular Weight 240.343 g/mol
SMILES OC(C#CC(OC(C)=O)C)(C(C)C)C(C)(C)C
SPLASH splash10-05gl-9700000000-1cc7540f8721c920a4bf
Wiley ID 1481992