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(3S)-(-)-3-hydroxy-1-methylpiperidin-2-one
SpectraBase Compound ID 4nzoTBpAwYu
InChI InChI=1S/C6H11NO2/c1-7-4-2-3-5(8)6(7)9/h5,8H,2-4H2,1H3/t5-/m0/s1
InChIKey PESIJJGWDALPCW-YFKPBYRVSA-N
Mol Weight 129.16 g/mol
Molecular Formula C6H11NO2
Exact Mass 129.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76Skr63o2le
Name (3S)-(-)-3-hydroxy-1-methylpiperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11NO2
InChI InChI=1S/C6H11NO2/c1-7-4-2-3-5(8)6(7)9/h5,8H,2-4H2,1H3/t5-/m0/s1
InChIKey PESIJJGWDALPCW-YFKPBYRVSA-N
Instrument Name Shimadzu GCMS-QP5050A
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202200182
Molecular Weight 129.159 g/mol
Optical Rotation [a]D23 = -0.021 (c = 0.0483, methanol)
SMILES O[C@@]1(C(N(CCC1)C)=O)[H]
SPLASH splash10-001i-9000000000-680429a35ef25f92b203
Source of Spectrum AJO-11-SM16-1a
Wiley ID 1870776