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(2S)-1-Acetoxy-2,6,10-trimethylundecan-4-one
SpectraBase Compound ID DoU5T6uo7nG
InChI InChI=1S/C16H30O3/c1-12(2)7-6-8-13(3)9-16(18)10-14(4)11-19-15(5)17/h12-14H,6-11H2,1-5H3/t13-,14-/m0/s1
InChIKey HCWZKCVSFQDBDW-KBPBESRZSA-N
Mol Weight 270.41 g/mol
Molecular Formula C16H30O3
Exact Mass 270.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B07Y7Sytrp7
Name (2S)-1-Acetoxy-2,6,10-trimethylundecan-4-one
Alternate Name(s) Acetic acid (2S,6S)-2,6,10-trimethyl-4-oxo-undecyl ester Acetic acid[(2S)-2,6,10-trimethyl-4-oxoundecyl]ester Acetic acid[(2S)-4-keto-2,6,10-trimethyl-undecyl]ester [(2S)-2,6,10-trimethyl-4-oxidanylidene-undecyl]ethanoate [(2S)-2,6,10-trimethyl-4-oxo-undecyl]acetate
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Formula C16H30O3
InChI InChI=1S/C16H30O3/c1-12(2)7-6-8-13(3)9-16(18)10-14(4)11-19-15(5)17/h12-14H,6-11H2,1-5H3/t13-,14-/m0/s1
InChIKey HCWZKCVSFQDBDW-KBPBESRZSA-N
Molecular Weight 270.413 g/mol
SMILES C(=O)(OC[C@](CC(=O)C[C@](CCCC(C)C)(C)[H])(C)[H])C
SPLASH splash10-0002-9000000000-9de64cd02df5bc6dd30a
Source of Spectrum J-59-3451-2
Wiley ID 1274499