CID 135876279

1899-60-1

Structural Information

Molecular Formula

C₆H₁₀N₄O

SMILES

CCC1=CC(=O)NC(=N1)NN

InChI

InChI=1S/C6H10N4O/c1-2-4-3-5(11)9-6(8-4)10-7/h3H,2,7H2,1H3,(H2,8,9,10,11)

InChIKey

WPIOYZBFXCKCMM-UHFFFAOYSA-N

Compound name

4-ethyl-2-hydrazinyl-1H-pyrimidin-6-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 5
Patents: 154.08546 Da
Monoisotopic Mass: -0.8
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]+	155.092736	130.8
[M+Na]+	177.074678	139.6
[M-H]-	153.078184	130.7
[M+NH4]+	172.119283	148.1
[M+K]+	193.048618	136.5
[M+H-H2O]+	137.082720	123.7
[M+HCOO]-	199.083661	154.0
[M+CH3COO]-	213.099311	177.9
[M+Na-2H]-	175.060126	138.3
[M]+	154.08491142	127.7
[M]-	154.08600858	127.7

Literature stripe

literature stripe

Patent stripe

patents stripe