CID 21694903

1-[(2-fluorophenyl)methyl]cyclopropane-1-carboxylic acid

Structural Information

Molecular Formula
C11H11FO2
SMILES
C1CC1(CC2=CC=CC=C2F)C(=O)O
InChI
InChI=1S/C11H11FO2/c12-9-4-2-1-3-8(9)7-11(5-6-11)10(13)14/h1-4H,5-7H2,(H,13,14)
InChIKey
RLTHGOMIUBXLQH-UHFFFAOYSA-N
Compound name
1-[(2-fluorophenyl)methyl]cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

194.07431 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.08159 145.9
[M+Na]+ 217.06353 158.5
[M+NH4]+ 212.10813 155.4
[M+K]+ 233.03747 152.3
[M-H]- 193.06703 154.0
[M+Na-2H]- 215.04898 155.9
[M]+ 194.07376 151.1
[M]- 194.07486 151.1
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

patents stripe