CID 3062746

Dtxsid20913067

Structural Information

Molecular Formula
C16H23N3
SMILES
CCC(C(C1=CC=CC=C1)N(C)C)N2C=CN=C2C
InChI
InChI=1S/C16H23N3/c1-5-15(19-12-11-17-13(19)2)16(18(3)4)14-9-7-6-8-10-14/h6-12,15-16H,5H2,1-4H3
InChIKey
SMDMJPXCOOBYNF-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(2-methylimidazol-1-yl)-1-phenylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.1892 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.196476 163.5
[M+Na]+ 280.178418 168.8
[M-H]- 256.181924 168.6
[M+NH4]+ 275.223023 179.6
[M+K]+ 296.152358 166.6
[M+H-H2O]+ 240.186460 154.1
[M+HCOO]- 302.187401 184.9
[M+CH3COO]- 316.203051 204.4
[M+Na-2H]- 278.163866 164.6
[M]+ 257.18865142 164.8
[M]- 257.18974858 164.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.