CID 83906486

1547039-10-0

Structural Information

Molecular Formula
C10H12FNO
SMILES
C1CC(C2=C1C=C(C=C2)F)(CN)O
InChI
InChI=1S/C10H12FNO/c11-8-1-2-9-7(5-8)3-4-10(9,13)6-12/h1-2,5,13H,3-4,6,12H2
InChIKey
XDGGHCFIHUIYGR-UHFFFAOYSA-N
Compound name
1-(aminomethyl)-5-fluoro-2,3-dihydroinden-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.09029 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.09757 136.4
[M+Na]+ 204.07951 146.5
[M+NH4]+ 199.12411 146.4
[M+K]+ 220.05345 140.4
[M-H]- 180.08301 137.3
[M+Na-2H]- 202.06496 142.1
[M]+ 181.08974 138.0
[M]- 181.09084 138.0
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.