CID 103845

53817-44-0

Structural Information

Molecular Formula

C₁₅H₂₃NO

SMILES

CC1CC(N(C2=C1C=CC(=C2)C)CCO)(C)C

InChI

InChI=1S/C15H23NO/c1-11-5-6-13-12(2)10-15(3,4)16(7-8-17)14(13)9-11/h5-6,9,12,17H,7-8,10H2,1-4H3

InChIKey

DICAWUKDDRKZDZ-UHFFFAOYSA-N

Compound name

2-(2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 57
Patents: 233.17796 Da
Monoisotopic Mass: 3.1
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]+	234.18524	155.4
[M+Na]+	256.16718	164.0
[M-H]-	232.17068	157.4
[M+NH4]+	251.21178	175.4
[M+K]+	272.14112	160.1
[M+H-H2O]+	216.17522	149.4
[M+HCOO]-	278.17616	172.4
[M+CH3COO]-	292.19181	193.7
[M+Na-2H]-	254.15263	159.6
[M]+	233.17741	155.4
[M]-	233.17851	155.4

Literature stripe

literature stripe

Patent stripe

patents stripe