CID 3069547

Brn 4486979

Structural Information

Molecular Formula
C16H22N4
SMILES
CN1CCCC1=NC2=CC=C(C=C2)N=C3CCCN3C
InChI
InChI=1S/C16H22N4/c1-19-11-3-5-15(19)17-13-7-9-14(10-8-13)18-16-6-4-12-20(16)2/h7-10H,3-6,11-12H2,1-2H3
InChIKey
CDOROLSAXFLVQS-UHFFFAOYSA-N
Compound name
1-methyl-N-[4-[(1-methylpyrrolidin-2-ylidene)amino]phenyl]pyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.18445 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.19173 166.7
[M+Na]+ 293.17367 176.8
[M+NH4]+ 288.21827 174.9
[M+K]+ 309.14761 172.8
[M-H]- 269.17717 172.4
[M+Na-2H]- 291.15912 173.6
[M]+ 270.18390 169.4
[M]- 270.18500 169.4
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

No patent data available for this compound.