CID 72698788

1378834-16-2

Structural Information

Molecular Formula
C10H8FNO
SMILES
C1CC12C3=C(C=C(C=C3)F)NC2=O
InChI
InChI=1S/C10H8FNO/c11-6-1-2-7-8(5-6)12-9(13)10(7)3-4-10/h1-2,5H,3-4H2,(H,12,13)
InChIKey
MGSBFWIIFWQXSG-UHFFFAOYSA-N
Compound name
6-fluorospiro[1H-indole-3,1'-cyclopropane]-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

177.05899 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.066266 136.3
[M+Na]+ 200.048208 148.8
[M-H]- 176.051714 140.6
[M+NH4]+ 195.092813 155.0
[M+K]+ 216.022148 143.8
[M+H-H2O]+ 160.056250 130.2
[M+HCOO]- 222.057191 156.1
[M+CH3COO]- 236.072841 149.8
[M+Na-2H]- 198.033656 142.8
[M]+ 177.05844142 136.0
[M]- 177.05953858 136.0
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