CID 84080043

Methyl 6-fluoroindoline-2-carboxylate

Structural Information

Molecular Formula
C10H10FNO2
SMILES
COC(=O)C1CC2=C(N1)C=C(C=C2)F
InChI
InChI=1S/C10H10FNO2/c1-14-10(13)9-4-6-2-3-7(11)5-8(6)12-9/h2-3,5,9,12H,4H2,1H3
InChIKey
TVVUNKCOKJKNIJ-UHFFFAOYSA-N
Compound name
methyl 6-fluoro-2,3-dihydro-1H-indole-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.06955 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.07683 141.2
[M+Na]+ 218.05877 151.7
[M+NH4]+ 213.10337 148.6
[M+K]+ 234.03271 148.0
[M-H]- 194.06227 140.3
[M+Na-2H]- 216.04422 144.6
[M]+ 195.06900 142.1
[M]- 195.07010 142.1
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.