CID 468604

40640-53-7

Structural Information

Molecular Formula

C₆H₈N₄O₂

SMILES

CC1=NC=C(C(=O)N1)C(=O)NN

InChI

InChI=1S/C6H8N4O2/c1-3-8-2-4(5(11)9-3)6(12)10-7/h2H,7H2,1H3,(H,10,12)(H,8,9,11)

InChIKey

XPOJDTNDWVIPQV-UHFFFAOYSA-N

Compound name

2-methyl-6-oxo-1H-pyrimidine-5-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 168.06473 Da
Monoisotopic Mass: -1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	169.07201	133.2
[M+Na]+	191.05395	142.0
[M-H]-	167.05745	133.3
[M+NH4]+	186.09855	149.8
[M+K]+	207.02789	139.4
[M+H-H2O]+	151.06199	126.1
[M+HCOO]-	213.06293	155.9
[M+CH3COO]-	227.07858	179.5
[M+Na-2H]-	189.03940	139.5
[M]+	168.06418	130.2
[M]-	168.06528	130.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.