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Ethyl 2-(1-adamantyl)-3-oxobutanoate
SpectraBase Compound ID Ao61IolBdgW
InChI InChI=1S/C16H24O3/c1-3-19-15(18)14(10(2)17)16-7-11-4-12(8-16)6-13(5-11)9-16/h11-14H,3-9H2,1-2H3/t11-,12+,13-,14?,16-
InChIKey KJAUPJVVFIJSEI-JCSQNLFZSA-N
Mol Weight 264.36 g/mol
Molecular Formula C16H24O3
Exact Mass 264.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Q1A2sFGV6T
Name Ethyl 2-(1-adamantyl)-3-oxobutanoate
Alternate Name(s) 2-(1-adamantyl)-3-keto-butyric acid ethyl ester 2-(1-adamantyl)-3-oxobutanoic acid ethyl ester Butanoic acid, 2-(1-adamantyl)-3-oxo-, ethyl ester ethyl 2-(1-adamantyl)-3-oxidanylidene-butanoate ethyl 2-(1-adamantyl)-3-oxo-butanoate
CAS Registry Number 30504-23-5
Comments Less than 3 mono-isotopic peaks
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Formula C16H24O3
InChI InChI=1S/C16H24O3/c1-3-19-15(18)14(10(2)17)16-7-11-4-12(8-16)6-13(5-11)9-16/h11-14H,3-9H2,1-2H3/t11-,12+,13-,14?,16-
InChIKey KJAUPJVVFIJSEI-JCSQNLFZSA-N
Molecular Weight 264.365 g/mol
SMILES C12(C(C(=O)OCC)C(=O)C)C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-000i-0900000000-b4193bb71a83e29b4ace
Source of Spectrum QC-11-4553-5
Wiley ID 860214