CID 14795869

5-fluoro-2,3-dihydro-1h-isoindole

Structural Information

Molecular Formula
C8H8FN
SMILES
C1C2=C(CN1)C=C(C=C2)F
InChI
InChI=1S/C8H8FN/c9-8-2-1-6-4-10-5-7(6)3-8/h1-3,10H,4-5H2
InChIKey
UYIALDLZAMTNLK-UHFFFAOYSA-N
Compound name
5-fluoro-2,3-dihydro-1H-isoindole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

432
Patents

137.06407 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.07135 125.9
[M+Na]+ 160.05329 137.8
[M+NH4]+ 155.09789 135.3
[M+K]+ 176.02723 132.6
[M-H]- 136.05679 126.5
[M+Na-2H]- 158.03874 131.6
[M]+ 137.06352 127.6
[M]- 137.06462 127.6
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

patents stripe