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2-HYDROXY-3-METHYL-PENTANOIC-ACID
SpectraBase Compound ID CC6KF6Da9Cx
InChI InChI=1S/C6H12O3/c1-3-4(2)5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t4-,5-/m0/s1
InChIKey RILPIWOPNGRASR-WHFBIAKZSA-N
Mol Weight 132.16 g/mol
Molecular Formula C6H12O3
Exact Mass 132.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LonCatUozAO
Name (+)-(2S, 3S)-2-Hydroxy-3-methylpentanoic acid
Classification Hydroxy fatty acids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 132.078644243 u
Formula C6H12O3
InChI InChI=1S/C6H12O3/c1-3-4(2)5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t4-,5-/m0/s1
InChIKey RILPIWOPNGRASR-WHFBIAKZSA-N
Molecular Weight 132.159 g/mol
Number of Peaks 8
SMILES OC([C@]([C@](CC)(C)[H])(O)[H])=O
SPLASH splash10-004i-9000000000-acbcacb62b260a25c397
Source of Spectrum FF-20-376-(+)_11 (DOI: 10.1002/ffj.1510)
Synonyms (2S,3S)-2-hydroxy-3-methylpentanoic acid (2S,3S)-2-hydroxy-3-methyl-pentanoic acid (2S,3S)-3-methyl-2-oxidanyl-pentanoic acid
Wiley ID 1775388