CID 5708483

5-fluoro-3-(2-nitrovinyl)indole

Structural Information

Molecular Formula
C10H7FN2O2
SMILES
C1=CC2=C(C=C1F)C(=CN2)/C=C/[N+](=O)[O-]
InChI
InChI=1S/C10H7FN2O2/c11-8-1-2-10-9(5-8)7(6-12-10)3-4-13(14)15/h1-6,12H/b4-3+
InChIKey
RFGJWSVNMVSDEH-ONEGZZNKSA-N
Compound name
5-fluoro-3-[(E)-2-nitroethenyl]-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.04915 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.05643 137.1
[M+Na]+ 229.03837 150.2
[M+NH4]+ 224.08297 144.7
[M+K]+ 245.01231 148.0
[M-H]- 205.04187 138.2
[M+Na-2H]- 227.02382 142.6
[M]+ 206.04860 138.9
[M]- 206.04970 138.9
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.