CID 84618413

5'-fluoro-1',2'-dihydrospiro[cyclobutane-1,3'-indole]

Structural Information

Molecular Formula
C11H12FN
SMILES
C1CC2(C1)CNC3=C2C=C(C=C3)F
InChI
InChI=1S/C11H12FN/c12-8-2-3-10-9(6-8)11(7-13-10)4-1-5-11/h2-3,6,13H,1,4-5,7H2
InChIKey
HGTCFNGBHOMFON-UHFFFAOYSA-N
Compound name
5-fluorospiro[1,2-dihydroindole-3,1'-cyclobutane]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.09538 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.10266 133.9
[M+Na]+ 200.08460 141.8
[M-H]- 176.08810 137.0
[M+NH4]+ 195.12920 151.0
[M+K]+ 216.05854 140.1
[M+H-H2O]+ 160.09264 123.1
[M+HCOO]- 222.09358 151.8
[M+CH3COO]- 236.10923 146.5
[M+Na-2H]- 198.07005 140.1
[M]+ 177.09483 137.7
[M]- 177.09593 137.7
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.