CID 24266834

6-methoxy-3-(propan-2-yl)-1,2,3,4-tetrahydroquinoline hydrochloride

Structural Information

Molecular Formula
C13H19NO
SMILES
CC(C)C1CC2=C(C=CC(=C2)OC)NC1
InChI
InChI=1S/C13H19NO/c1-9(2)11-6-10-7-12(15-3)4-5-13(10)14-8-11/h4-5,7,9,11,14H,6,8H2,1-3H3
InChIKey
JUPSTCXLRFVYBY-UHFFFAOYSA-N
Compound name
6-methoxy-3-propan-2-yl-1,2,3,4-tetrahydroquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.153946 147.8
[M+Na]+ 228.135888 154.0
[M-H]- 204.139394 149.0
[M+NH4]+ 223.180493 166.1
[M+K]+ 244.109828 150.7
[M+H-H2O]+ 188.143930 141.1
[M+HCOO]- 250.144871 164.4
[M+CH3COO]- 264.160521 186.7
[M+Na-2H]- 226.121336 152.0
[M]+ 205.14612142 145.2
[M]- 205.14721858 145.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.