CID 100571

84859-11-0

Structural Information

Molecular Formula
C12H22N4
SMILES
CN1CCCC1=NCCN=C2CCCN2C
InChI
InChI=1S/C12H22N4/c1-15-9-3-5-11(15)13-7-8-14-12-6-4-10-16(12)2/h3-10H2,1-2H3
InChIKey
GPUATYRBUQJDLG-UHFFFAOYSA-N
Compound name
1-methyl-N-[2-[(1-methylpyrrolidin-2-ylidene)amino]ethyl]pyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.18445 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.19173 154.3
[M+Na]+ 245.17367 158.9
[M-H]- 221.17717 160.1
[M+NH4]+ 240.21827 174.0
[M+K]+ 261.14761 157.4
[M+H-H2O]+ 205.18171 145.1
[M+HCOO]- 267.18265 177.8
[M+CH3COO]- 281.19830 197.3
[M+Na-2H]- 243.15912 154.6
[M]+ 222.18390 151.0
[M]- 222.18500 151.0
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.