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Pethidinic acid

View entire compound with spectra: 4 MS (GC)

Pethidinic acid
SpectraBase Compound ID GMg0CQFUAKw
InChI InChI=1S/C13H17NO2/c1-14-9-7-13(8-10-14,12(15)16)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,15,16)
InChIKey KHUPPYUUMRDAAX-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRMk74VCQAD
Name 1-Methyl-4-phenyl-4-piperidinecarboxylic acid
Alternate Name(s) 1-Methyl-4-phenyl-4-piperidin-1-iumcarboxylate 1-Methyl-4-phenyl-isonipecotic acid 1-Methyl-4-phenyl-piperidin-1-ium-4-carboxylate 1-Methyl-4-phenyl-piperidine-4-carboxylic acid 4-Piperidinecarboxylic acid, 1-methyl-4-phenyl- Isonipecotic acid, 1-methyl-4-phenyl- Meperdinic acid Meperidine acid Meperidinic acid Pethidinic acid NSC 400459
CAS Registry Number 3627-48-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-14-9-7-13(8-10-14,12(15)16)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,15,16)
InChIKey KHUPPYUUMRDAAX-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES OC(=O)C1(CCN(C)CC1)c1ccccc1
SPLASH splash10-00dl-9120000000-69df5e23d1d6d842fad4
Source of Spectrum JZ-1992-1844-0
Wiley ID 1218911