CID 493230

(6-butyl-4-quinolyl)hydrazine

Structural Information

Molecular Formula

C₁₃H₁₇N₃

SMILES

CCCCC1=CC2=C(C=CN=C2C=C1)NN

InChI

InChI=1S/C13H17N3/c1-2-3-4-10-5-6-12-11(9-10)13(16-14)7-8-15-12/h5-9H,2-4,14H2,1H3,(H,15,16)

InChIKey

QFOLYEDGEQIFHP-UHFFFAOYSA-N

Compound name

(6-butylquinolin-4-yl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 215.14224 Da
Monoisotopic Mass: 3.3
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]+	216.149516	148.3
[M+Na]+	238.131458	155.7
[M-H]-	214.134964	151.0
[M+NH4]+	233.176063	166.2
[M+K]+	254.105398	151.4
[M+H-H2O]+	198.139500	140.7
[M+HCOO]-	260.140441	171.6
[M+CH3COO]-	274.156091	194.9
[M+Na-2H]-	236.116906	156.1
[M]+	215.14169142	147.3
[M]-	215.14278858	147.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.