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anti-(2S,3S)-3-Hydroxy-2-methylvaleric acid 4-oxopentyl ester
SpectraBase Compound ID 7F0Fa9Ugn9a
InChI InChI=1S/C11H20O4/c1-4-10(13)9(3)11(14)15-7-5-6-8(2)12/h9-10,13H,4-7H2,1-3H3/t9-,10-/m0/s1
InChIKey NZIZKMKIPFUOGL-UWVGGRQHSA-N
Mol Weight 216.28 g/mol
Molecular Formula C11H20O4
Exact Mass 216.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32M0ILm3juC
Name anti-(2S,3S)-3-Hydroxy-2-methylvaleric acid 4-oxopentyl ester
Alternate Name(s) 4-Oxopentyl (2S,3S)-3-hydroxy-2-methylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O4
InChI InChI=1S/C11H20O4/c1-4-10(13)9(3)11(14)15-7-5-6-8(2)12/h9-10,13H,4-7H2,1-3H3/t9-,10-/m0/s1
InChIKey NZIZKMKIPFUOGL-UWVGGRQHSA-N
Literature Reference DOI 10.1002/cbic.201800799
Molecular Weight 216.277 g/mol
SMILES O[C@@](CC)([C@@](C(=O)OCCCC(C)=O)(C)[H])[H]
SPLASH splash10-000i-9100000000-d58598fdc017b677fe6c
Source of Spectrum CBC-20-SM15-5b
Wiley ID 1819381