CID 487253

6-oxopiperidine-2-carbohydrazide

Structural Information

Molecular Formula

C₆H₁₁N₃O₂

SMILES

C1CC(NC(=O)C1)C(=O)NN

InChI

InChI=1S/C6H11N3O2/c7-9-6(11)4-2-1-3-5(10)8-4/h4H,1-3,7H2,(H,8,10)(H,9,11)

InChIKey

HSZSNAOESKLCCG-UHFFFAOYSA-N

Compound name

6-oxopiperidine-2-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 157.08513 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]+	158.09241	132.7
[M+Na]+	180.07435	137.4
[M-H]-	156.07785	132.6
[M+NH4]+	175.11895	150.4
[M+K]+	196.04829	135.8
[M+H-H2O]+	140.08239	126.2
[M+HCOO]-	202.08333	152.3
[M+CH3COO]-	216.09898	176.4
[M+Na-2H]-	178.05980	136.6
[M]+	157.08458	124.4
[M]-	157.08568	124.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe