CID 468615

Schembl2993555

Structural Information

Molecular Formula
C12H18N4O
SMILES
CC1CCC(N1NNC(=O)C2=CC=NC=C2)C
InChI
InChI=1S/C12H18N4O/c1-9-3-4-10(2)16(9)15-14-12(17)11-5-7-13-8-6-11/h5-10,15H,3-4H2,1-2H3,(H,14,17)
InChIKey
POIAEGNGLOAVSQ-UHFFFAOYSA-N
Compound name
N'-(2,5-dimethylpyrrolidin-1-yl)pyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

234.14806 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.15534 153.8
[M+Na]+ 257.13728 159.3
[M-H]- 233.14078 157.7
[M+NH4]+ 252.18188 170.0
[M+K]+ 273.11122 156.5
[M+H-H2O]+ 217.14532 144.9
[M+HCOO]- 279.14626 175.7
[M+CH3COO]- 293.16191 195.5
[M+Na-2H]- 255.12273 156.8
[M]+ 234.14751 150.6
[M]- 234.14861 150.6
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