CID 83849951

2375270-00-9

Structural Information

Molecular Formula
C11H13FN2O2
SMILES
CN1CCN(C2=C1C=C(C=C2)F)CC(=O)O
InChI
InChI=1S/C11H13FN2O2/c1-13-4-5-14(7-11(15)16)9-3-2-8(12)6-10(9)13/h2-3,6H,4-5,7H2,1H3,(H,15,16)
InChIKey
UNQHQRZKVXFAEV-UHFFFAOYSA-N
Compound name
2-(6-fluoro-4-methyl-2,3-dihydroquinoxalin-1-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.0961 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.10338 149.6
[M+Na]+ 247.08532 161.0
[M+NH4]+ 242.12992 156.2
[M+K]+ 263.05926 155.5
[M-H]- 223.08882 148.6
[M+Na-2H]- 245.07077 153.0
[M]+ 224.09555 150.6
[M]- 224.09665 150.6
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.