CID 76045

N-(1-methylpiperidin-4-ylidene)acetohydrazide

Structural Information

Molecular Formula

C₈H₁₅N₃O

SMILES

CC(=O)NN=C1CCN(CC1)C

InChI

InChI=1S/C8H15N3O/c1-7(12)9-10-8-3-5-11(2)6-4-8/h3-6H2,1-2H3,(H,9,12)

InChIKey

FIIVJDIEDSXVNJ-UHFFFAOYSA-N

Compound name

N-[(1-methylpiperidin-4-ylidene)amino]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 169.1215 Da
Monoisotopic Mass: -0.5
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]+	170.128776	137.8
[M+Na]+	192.110718	142.6
[M-H]-	168.114224	140.7
[M+NH4]+	187.155323	156.9
[M+K]+	208.084658	142.2
[M+H-H2O]+	152.118760	130.6
[M+HCOO]-	214.119701	160.2
[M+CH3COO]-	228.135351	185.3
[M+Na-2H]-	190.096166	142.7
[M]+	169.12095142	133.5
[M]-	169.12204858	133.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe