CID 50379

69352-55-2

Structural Information

Molecular Formula

C₇H₁₁N₃O₃

SMILES

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

InChI

InChI=1S/C7H11N3O3/c1-5-4-6(10-13-5)7(12)9-8-2-3-11/h4,8,11H,2-3H2,1H3,(H,9,12)

InChIKey

FATLUVZBHLRIQC-UHFFFAOYSA-N

Compound name

N'-(2-hydroxyethyl)-5-methyl-1,2-oxazole-3-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 185.08005 Da
Monoisotopic Mass: -0.7
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]+	186.08733	138.3
[M+Na]+	208.06927	145.0
[M-H]-	184.07277	140.2
[M+NH4]+	203.11387	155.8
[M+K]+	224.04321	144.9
[M+H-H2O]+	168.07731	131.3
[M+HCOO]-	230.07825	162.3
[M+CH3COO]-	244.09390	182.0
[M+Na-2H]-	206.05472	144.3
[M]+	185.07950	139.0
[M]-	185.08060	139.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe