CID 472393

6-ethoxy-4-hydrazinyl-2-methylquinoline

Structural Information

Molecular Formula

C₁₂H₁₅N₃O

SMILES

CCOC1=CC2=C(C=C(N=C2C=C1)C)NN

InChI

InChI=1S/C12H15N3O/c1-3-16-9-4-5-11-10(7-9)12(15-13)6-8(2)14-11/h4-7H,3,13H2,1-2H3,(H,14,15)

InChIKey

IAHYHTQMLUFSMP-UHFFFAOYSA-N

Compound name

(6-ethoxy-2-methylquinolin-4-yl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 217.1215 Da
Monoisotopic Mass: 2.2
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]+	218.128776	147.5
[M+Na]+	240.110718	156.2
[M-H]-	216.114224	150.7
[M+NH4]+	235.155323	165.5
[M+K]+	256.084658	152.7
[M+H-H2O]+	200.118760	140.1
[M+HCOO]-	262.119701	171.3
[M+CH3COO]-	276.135351	195.2
[M+Na-2H]-	238.096166	155.1
[M]+	217.12095142	148.0
[M]-	217.12204858	148.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe