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(2R*,3R*,4S*)-4-(Bromomethyl)-2-butyl-3-hydroxy-4-butanolide

View entire compound with spectra: 1 MS (GC)

(2R*,3R*,4S*)-4-(Bromomethyl)-2-butyl-3-hydroxy-4-butanolide
SpectraBase Compound ID LwoB1z6FmQc
InChI InChI=1S/C9H15BrO3/c1-2-3-4-6-8(11)7(5-10)13-9(6)12/h6-8,11H,2-5H2,1H3/t6-,7-,8-/m1/s1
InChIKey KQEVQQVYWDEEAH-BWZBUEFSSA-N
Mol Weight 251.12 g/mol
Molecular Formula C9H15BrO3
Exact Mass 250.020457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CqZFcBPFvMt
Name (2R*,3R*,4S*)-4-(Bromomethyl)-2-butyl-3-hydroxy-4-butanolide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15BrO3
InChI InChI=1S/C9H15BrO3/c1-2-3-4-6-8(11)7(5-10)13-9(6)12/h6-8,11H,2-5H2,1H3/t6-,7-,8-/m1/s1
InChIKey KQEVQQVYWDEEAH-BWZBUEFSSA-N
Molecular Weight 251.120 g/mol
SMILES O[C@@]1([C@](C(O[C@@]1(CBr)[H])=O)(CCCC)[H])[H]
SPLASH splash10-0pbc-9810000000-e1b6fee9cca1d274c7f3
Source of Spectrum J-58-2952-25
Synonyms (3R,4R,5S)-5-(bromomethyl)-3-butyl-4-hydroxy-2-oxolanone (3R,4R,5S)-5-(bromomethyl)-3-butyl-4-hydroxyoxolan-2-one (3R,4R,5S)-5-(bromomethyl)-3-butyl-4-oxidanyl-oxolan-2-one
Wiley ID 1254244