CID 16244400

7-fluoro-1,2,3,4-tetrahydroisoquinoline

Structural Information

Molecular Formula
C9H10FN
SMILES
C1CNCC2=C1C=CC(=C2)F
InChI
InChI=1S/C9H10FN/c10-9-2-1-7-3-4-11-6-8(7)5-9/h1-2,5,11H,3-4,6H2
InChIKey
LNORDFUGQNAJMQ-UHFFFAOYSA-N
Compound name
7-fluoro-1,2,3,4-tetrahydroisoquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

311
Patents

151.07973 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08701 130.1
[M+Na]+ 174.06895 142.9
[M+NH4]+ 169.11355 139.6
[M+K]+ 190.04289 135.4
[M-H]- 150.07245 131.5
[M+Na-2H]- 172.05440 136.6
[M]+ 151.07918 132.2
[M]- 151.08028 132.2
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