CID 3039743

Pyrrolidine, 1-butyl-2-((3,4-dimethylphenyl)imino)-

Structural Information

Molecular Formula
C16H24N2
SMILES
CCCCN1CCCC1=NC2=CC(=C(C=C2)C)C
InChI
InChI=1S/C16H24N2/c1-4-5-10-18-11-6-7-16(18)17-15-9-8-13(2)14(3)12-15/h8-9,12H,4-7,10-11H2,1-3H3
InChIKey
FKBSBVFWOGPWMX-UHFFFAOYSA-N
Compound name
1-butyl-N-(3,4-dimethylphenyl)pyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.19395 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.20123 160.2
[M+Na]+ 267.18317 166.6
[M-H]- 243.18667 166.5
[M+NH4]+ 262.22777 178.9
[M+K]+ 283.15711 162.9
[M+H-H2O]+ 227.19121 152.1
[M+HCOO]- 289.19215 183.3
[M+CH3COO]- 303.20780 200.6
[M+Na-2H]- 265.16862 161.4
[M]+ 244.19340 160.0
[M]- 244.19450 160.0
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.