CID 135762281

2-hydrazinyl-6-propyl-3,4-dihydropyrimidin-4-one

Structural Information

Molecular Formula
C7H12N4O
SMILES
CCCC1=CC(=O)NC(=N1)NN
InChI
InChI=1S/C7H12N4O/c1-2-3-5-4-6(12)10-7(9-5)11-8/h4H,2-3,8H2,1H3,(H2,9,10,11,12)
InChIKey
JKECXKVCNVYPEG-UHFFFAOYSA-N
Compound name
2-hydrazinyl-4-propyl-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

168.1011 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.10838 135.2
[M+Na]+ 191.09032 143.6
[M-H]- 167.09382 134.9
[M+NH4]+ 186.13492 151.9
[M+K]+ 207.06426 140.3
[M+H-H2O]+ 151.09836 127.9
[M+HCOO]- 213.09930 158.1
[M+CH3COO]- 227.11495 180.9
[M+Na-2H]- 189.07577 142.2
[M]+ 168.10055 132.5
[M]- 168.10165 132.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe