Guvacoline

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Systematic / IUPAC Name: Methyl 1,2,3,6-tetrahydropyridine-5-carboxylate

ID: Reference6135

Other Names: Norarecoline;
1,2,5,6-Tetrahydro-pyridine-3-carboxylic acid methyl ester;
3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-, methyl ester;
Guvacine methyl ester;
Methyl 1,2,5,6-tetrahydro-3-pyridinecarboxylate ; more

Formula: C7H11NO2

Class: Endogenous Metabolites

Spectral Data

Guvacoline mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 213
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers IT; FT
Last Modification 12/1/2016 10:02:29 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C7H11NO2/c1-10-7(9)6-3-2-4-8-5-6/h3,8H,2,4-5H2,1H3
InChI Key DYPLDWLIOGXSSE-UHFFFAOYSA-N
Canonical SMILES COC(=O)C1=CCCNC1
CAS
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Other Names Norarecoline;
1,2,5,6-Tetrahydro-pyridine-3-carboxylic acid methyl ester;
3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-, methyl ester;
Guvacine methyl ester;
Methyl 1,2,5,6-tetrahydro-3-pyridinecarboxylate;
Methyl 1,2,5,6-tetrahydronicotinate;
Methyl 1,2,5,6-tetrahydropyridine-3-carboxylate

In Other Databases

PubChem 160492
ChEMBL CHEMBL268808
ChemSpider 141033
ChEBI CHEBI:80754
KEGG C16821
ChemIDPlus 000495192