1,3-Dibenzylhexahydropyrimidine-5-carbonitrile

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Systematic / IUPAC Name: 1,3-Dibenzylhexahydro-5-pyrimidinecarbonitrile

ID: Reference4016

Other Names: 1,3-Dibenzyl-5-cyanohexahydropyrimidine

Formula: C19H21N3

Spectral Data

1,3-Dibenzylhexahydropyrimidine-5-carbonitrile 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/1/2016 7:55:14 AM
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Identificators

InChI InChI=1S/C19H21N3/c20-11-19-14-21(12-17-7-3-1-4-8-17)16-22(15-19)13-18-9-5-2-6-10-18/h1-10,19H,12-16H2
InChI Key PSDQOOQJPHTEIA-UHFFFAOYSA-N
Canonical SMILES C1C(CN(CN1CC2=CC=CC=C2)CC3=CC=CC=C3)C#N
CAS
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Other Names 1,3-Dibenzyl-5-cyanohexahydropyrimidine

In Other Databases

ChemSpider 2084548
ChEMBL CHEMBL1566693
PubChem 2806026