CID 9588636

Brn 4423786

Structural Information

Molecular Formula
C12H17N3
SMILES
CC1=CC(=NC(=C1)/N=C/2\CCCN2C)C
InChI
InChI=1S/C12H17N3/c1-9-7-10(2)13-11(8-9)14-12-5-4-6-15(12)3/h7-8H,4-6H2,1-3H3/b14-12+
InChIKey
JPKJPHAYXGLENF-WYMLVPIESA-N
Compound name
(E)-N-(4,6-dimethylpyridin-2-yl)-1-methylpyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.14224 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.14952 146.6
[M+Na]+ 226.13146 154.8
[M-H]- 202.13496 152.2
[M+NH4]+ 221.17606 165.7
[M+K]+ 242.10540 152.0
[M+H-H2O]+ 186.13950 138.3
[M+HCOO]- 248.14044 169.7
[M+CH3COO]- 262.15609 191.3
[M+Na-2H]- 224.11691 149.9
[M]+ 203.14169 145.5
[M]- 203.14279 145.5
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.