CID 9556443

Hexanal methylformylhydrazone

Structural Information

Molecular Formula

C₈H₁₆N₂O

SMILES

CCCCC/C=N/N(C)C=O

InChI

InChI=1S/C8H16N2O/c1-3-4-5-6-7-9-10(2)8-11/h7-8H,3-6H2,1-2H3/b9-7+

InChIKey

QRMNFHXPNKCTAG-VQHVLOKHSA-N

Compound name

N-[(E)-hexylideneamino]-N-methylformamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 156.12627 Da
Monoisotopic Mass: 1.6
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]+	157.13355	135.8
[M+Na]+	179.11549	141.7
[M-H]-	155.11899	138.6
[M+NH4]+	174.16009	157.6
[M+K]+	195.08943	142.5
[M+H-H2O]+	139.12353	129.7
[M+HCOO]-	201.12447	163.6
[M+CH3COO]-	215.14012	188.6
[M+Na-2H]-	177.10094	142.0
[M]+	156.12572	139.4
[M]-	156.12682	139.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.