CID 135747237

Dtxsid50430176

Structural Information

Molecular Formula
C10H16N4O
SMILES
CCC/C(=N\NC1=NC(=CC(=O)N1)C)/C
InChI
InChI=1S/C10H16N4O/c1-4-5-7(2)13-14-10-11-8(3)6-9(15)12-10/h6H,4-5H2,1-3H3,(H2,11,12,14,15)/b13-7-
InChIKey
GFNVWPOLZGTELU-QPEQYQDCSA-N
Compound name
4-methyl-2-[(2Z)-2-pentan-2-ylidenehydrazinyl]-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.13242 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.13970 147.4
[M+Na]+ 231.12164 155.0
[M-H]- 207.12514 148.7
[M+NH4]+ 226.16624 163.5
[M+K]+ 247.09558 152.2
[M+H-H2O]+ 191.12968 139.5
[M+HCOO]- 253.13062 170.7
[M+CH3COO]- 267.14627 192.4
[M+Na-2H]- 229.10709 153.2
[M]+ 208.13187 147.3
[M]- 208.13297 147.3
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.