3-[2-(Morpholinomethyl)-1H-pyrrol-1-yl]propanenitrile

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Systematic / IUPAC Name: 3-[2-(Morpholin-4-ylmethyl)pyrrol-1-yl]propanenitrile

ID: Reference5999

Other Names: 1H-Pyrrole-1-propanenitrile, 2-(4-morpholinylmethyl)-

Formula: C12H17N3O

Spectral Data

3-[2-(Morpholinomethyl)-1H-pyrrol-1-yl]propanenitrile 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
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/16/2016 8:28:32 AM
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Identificators

InChI InChI=1S/C12H17N3O/c13-4-2-6-15-5-1-3-12(15)11-14-7-9-16-10-8-14/h1,3,5H,2,6-11H2
InChI Key JXPHFRIWQQNRLV-UHFFFAOYSA-N
Canonical SMILES C1COCCN1CC2=CC=CN2CCC#N
CAS
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Other Names 1H-Pyrrole-1-propanenitrile, 2-(4-morpholinylmethyl)-

In Other Databases

PubChem 2814296
ChemSpider 2092685