CID 55974

89465-06-5

Structural Information

Molecular Formula

C₆H₉N₃O₂

SMILES

CC1=CC(=NO1)C(=O)NNC

InChI

InChI=1S/C6H9N3O2/c1-4-3-5(9-11-4)6(10)8-7-2/h3,7H,1-2H3,(H,8,10)

InChIKey

ZFLPNZSUWANLDK-UHFFFAOYSA-N

Compound name

N',5-dimethyl-1,2-oxazole-3-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 155.06947 Da
Monoisotopic Mass: 0.0
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]+	156.07675	130.8
[M+Na]+	178.05869	138.5
[M-H]-	154.06219	134.3
[M+NH4]+	173.10329	150.4
[M+K]+	194.03263	139.1
[M+H-H2O]+	138.06673	124.1
[M+HCOO]-	200.06767	156.5
[M+CH3COO]-	214.08332	179.2
[M+Na-2H]-	176.04414	137.8
[M]+	155.06892	131.6
[M]-	155.07002	131.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe