CID 3062755

98836-63-6

Structural Information

Molecular Formula
C16H23N3
SMILES
CCC(CC1=CC=CC=C1)(CN2C=CN=C2)N(C)C
InChI
InChI=1S/C16H23N3/c1-4-16(18(2)3,13-19-11-10-17-14-19)12-15-8-6-5-7-9-15/h5-11,14H,4,12-13H2,1-3H3
InChIKey
ZFJFCDMQBFDIHA-UHFFFAOYSA-N
Compound name
2-benzyl-1-imidazol-1-yl-N,N-dimethylbutan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.1892 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.196476 163.3
[M+Na]+ 280.178418 168.7
[M-H]- 256.181924 168.2
[M+NH4]+ 275.223023 179.4
[M+K]+ 296.152358 166.0
[M+H-H2O]+ 240.186460 154.0
[M+HCOO]- 302.187401 185.1
[M+CH3COO]- 316.203051 202.0
[M+Na-2H]- 278.163866 168.2
[M]+ 257.18865142 165.0
[M]- 257.18974858 165.0
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.