CID 9570634

Pentanal methylformylhydrazone

Structural Information

Molecular Formula

C₇H₁₄N₂O

SMILES

CCCC/C=N/N(C)C=O

InChI

InChI=1S/C7H14N2O/c1-3-4-5-6-8-9(2)7-10/h6-7H,3-5H2,1-2H3/b8-6+

InChIKey

IHTUGUQGWPOOJG-SOFGYWHQSA-N

Compound name

N-methyl-N-[(E)-pentylideneamino]formamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 142.11061 Da
Monoisotopic Mass: 1.1
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]+	143.117886	131.1
[M+Na]+	165.099828	137.4
[M-H]-	141.103334	134.1
[M+NH4]+	160.144433	153.6
[M+K]+	181.073768	138.5
[M+H-H2O]+	125.107870	125.3
[M+HCOO]-	187.108811	159.3
[M+CH3COO]-	201.124461	185.6
[M+Na-2H]-	163.085276	137.9
[M]+	142.11006142	134.3
[M]-	142.11115858	134.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.