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
3
Annotation Hits

2
References

58
Patents

233.17796 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.185236 155.4
[M+Na]+ 256.167178 164.0
[M-H]- 232.170684 157.4
[M+NH4]+ 251.211783 175.4
[M+K]+ 272.141118 160.1
[M+H-H2O]+ 216.175220 149.4
[M+HCOO]- 278.176161 172.4
[M+CH3COO]- 292.191811 193.7
[M+Na-2H]- 254.152626 159.6
[M]+ 233.17741142 155.4
[M]- 233.17850858 155.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe