CID 117031

71130-68-2

Structural Information

Molecular Formula

C₁₁H₁₅NO

SMILES

CCN1CCCC2=C1C=C(C=C2)O

InChI

InChI=1S/C11H15NO/c1-2-12-7-3-4-9-5-6-10(13)8-11(9)12/h5-6,8,13H,2-4,7H2,1H3

InChIKey

FQXSFGOFVUWZOD-UHFFFAOYSA-N

Compound name

1-ethyl-3,4-dihydro-2H-quinolin-7-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 177.11537 Da
Monoisotopic Mass: 2.4
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]+	178.122646	138.3
[M+Na]+	200.104588	145.7
[M-H]-	176.108094	139.9
[M+NH4]+	195.149193	157.8
[M+K]+	216.078528	142.5
[M+H-H2O]+	160.112630	132.0
[M+HCOO]-	222.113571	156.7
[M+CH3COO]-	236.129221	179.7
[M+Na-2H]-	198.090036	144.9
[M]+	177.11482142	135.7
[M]-	177.11591858	135.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe