Anhydroecgonine

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Systematic / IUPAC Name: 8-Methyl-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid

ID: Reference582

Other Names: (1R)-8-Methyl-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid;
8-Azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid, 8-methyl-, (1R)-;
Ecognidine

Formula: C9H13NO2

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

Anhydroecgonine 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 Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 112
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/9/2015 2:39:26 PM
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Identificators

InChI InChI=1S/C9H13NO2/c1-10-6-2-4-7(9(11)12)8(10)5-3-6/h4,6,8H,2-3,5H2,1H3,(H,11,12)
InChI Key HZGRVVUQEIBCMS-UHFFFAOYSA-N
Canonical SMILES CN1C2CCC1C(=CC2)C(=O)O
CAS 484935
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Other Names (1R)-8-Methyl-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid;
8-Azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid, 8-methyl-, (1R)-;
Ecognidine

In Other Databases

ChemIDPlus 000484935
Wikipedia Ecgonidine
ChemSpider 91897
PubChem 101709