2-(3,4-Dimethoxyphenyl)-5-methylamino-2-isopropylvaleronitrile

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Systematic / IUPAC Name: 2-(3,4-Dimethoxyphenyl)-2-isopropyl-5-(methylamino)pentanenitrile

ID: Reference1019

Other Names: 5-Methylamino-2-(3,4-dimethoxyphenyl-2-isopropylvaleronitrile;
N-Methyl-4-(3,4-dimethoxyphenyl)-4-cyano-5-methylhexylamine;
1-Isopropyl-1-n-methylpropylamino-(3,4-dimethoxyphenyl)acetonitrile;
3-(3,4-Dimethoxyphenyl)-2-methyl-6-methylaminohexane-3-carbonitrile;
3,4-Dimethoxy-α-(3-(methylamino)propyl)-α-(1-methylethyl)benzeneacetonitrile

Formula: C17H26N2O2

Class: Therapeutics/Prescription Drugs

Spectral Data

2-(3,4-Dimethoxyphenyl)-5-methylamino-2-isopropylvaleronitrile 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 LTQ Orbitrap XL
No. of Spectral Trees 1
No. of Spectra 53
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/12/2014 1:55:57 PM
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Identificators

InChI InChI=1S/C17H26N2O2/c1-13(2)17(12-18,9-6-10-19-3)14-7-8-15(20-4)16(11-14)21-5/h7-8,11,13,19H,6,9-10H2,1-5H3
InChI Key WLOBUUJURNEQCL-UHFFFAOYSA-N
Canonical SMILES CC(C)C(CCCNC)(C#N)C1=CC(=C(C=C1)OC)OC
CAS 34245142
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Other Names 5-Methylamino-2-(3,4-dimethoxyphenyl-2-isopropylvaleronitrile;
N-Methyl-4-(3,4-dimethoxyphenyl)-4-cyano-5-methylhexylamine;
1-Isopropyl-1-n-methylpropylamino-(3,4-dimethoxyphenyl)acetonitrile;
3-(3,4-Dimethoxyphenyl)-2-methyl-6-methylaminohexane-3-carbonitrile;
3,4-Dimethoxy-α-(3-(methylamino)propyl)-α-(1-methylethyl)benzeneacetonitrile;
Benzeneacetonitrile, 3,4-dimethoxy-α-[3-(methylamino)propyl]-α-(1-methylethyl)-

In Other Databases

ChemSpider 84112
ChEMBL CHEMBL1743342
PubChem 93168
ChemIDPlus 034245142