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Threo-methylphenidate

View entire compound with spectra: 2 MS (GC)

Threo-methylphenidate
SpectraBase Compound ID 9lshh2PCo3I
InChI InChI=1S/C14H19NO2/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3/t12-,13-/m1/s1
InChIKey DUGOZIWVEXMGBE-CHWSQXEVSA-N
Mol Weight 233.31 g/mol
Molecular Formula C14H19NO2
Exact Mass 233.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPiaZ4Fvd5J
Name Threo-methylphenidate
Alternate Name(s) (2R)-2-phenyl-2-[(2R)-2-piperidinyl]acetic acid methyl ester (2R)-2-phenyl-2-[(2R)-2-piperidyl]acetic acid methyl ester Methyl (2R)-2-phenyl-2-[(2R)-2-piperidyl]acetate Methyl (2R)-2-phenyl-2-[(2R)-piperidin-2-yl]acetate Methyl (2R)-2-phenyl-2-[(2R)-piperidin-2-yl]ethanoate Threo-methylphenydate
CAS Registry Number 52760-39-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO2
InChI InChI=1S/C14H19NO2/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3/t12-,13-/m1/s1
InChIKey DUGOZIWVEXMGBE-CHWSQXEVSA-N
Molecular Weight 233.311 g/mol
SMILES N1CCCC[C@@]1([C@](C(=O)OC)(c1ccccc1)[H])[H]
SPLASH splash10-001l-9000000000-343247e3c9f65f191097
Source of Spectrum XD-48-0-0
Wiley ID 1234992