CID 3062747

Jo 1231

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

257.1892 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.19648 163.3
[M+Na]+ 280.17842 169.6
[M-H]- 256.18192 168.6
[M+NH4]+ 275.22302 179.7
[M+K]+ 296.15236 166.9
[M+H-H2O]+ 240.18646 154.3
[M+HCOO]- 302.18740 185.1
[M+CH3COO]- 316.20305 203.1
[M+Na-2H]- 278.16387 167.5
[M]+ 257.18865 165.4
[M]- 257.18975 165.4
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

patents stripe