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(S)-iso-Propyl-2-hydroxy-3,3-dimethylbutanoate
SpectraBase Compound ID IkCgHVUAHN3
InChI InChI=1S/C9H18O3/c1-6(2)12-8(11)7(10)9(3,4)5/h6-7,10H,1-5H3/t7-/m1/s1
InChIKey KNHLYAIFWMVHCU-SSDOTTSWSA-N
Mol Weight 174.24 g/mol
Molecular Formula C9H18O3
Exact Mass 174.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10r6Y4ZY2K
Name (S)-iso-Propyl-2-hydroxy-3,3-dimethylbutanoate
Alternate Name(s) (S)-isopropyl 2-hydroxy-3,3-dimethylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O3
InChI InChI=1S/C9H18O3/c1-6(2)12-8(11)7(10)9(3,4)5/h6-7,10H,1-5H3/t7-/m1/s1
InChIKey KNHLYAIFWMVHCU-SSDOTTSWSA-N
Literature Reference DOI 10.1039/c4cc00427b
Molecular Weight 174.240 g/mol
SMILES O[C@@](C(C)(C)C)(C(OC(C)C)=O)[H]
SPLASH splash10-004i-9800000000-e040b36dfedfbc647864
Source of Spectrum KD-50-4489/SM22-2w
Wiley ID 1754486