CID 3068609

83658-14-4

Structural Information

Molecular Formula
C18H19FN2
SMILES
CN(C)CC1CC2=C(C=C(C=C2)F)C(=N1)C3=CC=CC=C3
InChI
InChI=1S/C18H19FN2/c1-21(2)12-16-10-14-8-9-15(19)11-17(14)18(20-16)13-6-4-3-5-7-13/h3-9,11,16H,10,12H2,1-2H3
InChIKey
JMSVUCDSDRKVIX-UHFFFAOYSA-N
Compound name
1-(7-fluoro-1-phenyl-3,4-dihydroisoquinolin-3-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.15323 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.16051 166.2
[M+Na]+ 305.14245 173.6
[M-H]- 281.14595 172.1
[M+NH4]+ 300.18705 182.1
[M+K]+ 321.11639 168.7
[M+H-H2O]+ 265.15049 155.8
[M+HCOO]- 327.15143 186.6
[M+CH3COO]- 341.16708 177.4
[M+Na-2H]- 303.12790 171.1
[M]+ 282.15268 165.0
[M]- 282.15378 165.0
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.