CID 117031

1-ethyl-1,2,3,4-tetrahydroquinolin-7-ol

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: 35
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]+	178.12265	138.4
[M+Na]+	200.10459	151.8
[M+NH4]+	195.14919	147.9
[M+K]+	216.07853	144.5
[M-H]-	176.10809	140.9
[M+Na-2H]-	198.09004	144.6
[M]+	177.11482	141.0
[M]-	177.11592	141.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe