CID 3068613

83658-17-7

Structural Information

Molecular Formula
C19H22N2O
SMILES
CN(C)CC1CC2=C(C=C(C=C2)OC)C(=N1)C3=CC=CC=C3
InChI
InChI=1S/C19H22N2O/c1-21(2)13-16-11-15-9-10-17(22-3)12-18(15)19(20-16)14-7-5-4-6-8-14/h4-10,12,16H,11,13H2,1-3H3
InChIKey
WDKXXUIFXYWYSC-UHFFFAOYSA-N
Compound name
1-(7-methoxy-1-phenyl-3,4-dihydroisoquinolin-3-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.17322 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.18050 170.9
[M+Na]+ 317.16244 177.6
[M-H]- 293.16594 178.1
[M+NH4]+ 312.20704 186.2
[M+K]+ 333.13638 173.7
[M+H-H2O]+ 277.17048 161.2
[M+HCOO]- 339.17142 192.2
[M+CH3COO]- 353.18707 211.3
[M+Na-2H]- 315.14789 175.9
[M]+ 294.17267 172.5
[M]- 294.17377 172.5
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.