CID 62669511

1-(2-chloro-6-fluorophenyl)cyclopropan-1-ol

Structural Information

Molecular Formula
C9H8ClFO
SMILES
C1CC1(C2=C(C=CC=C2Cl)F)O
InChI
InChI=1S/C9H8ClFO/c10-6-2-1-3-7(11)8(6)9(12)4-5-9/h1-3,12H,4-5H2
InChIKey
NICQKYAORFWDGI-UHFFFAOYSA-N
Compound name
1-(2-chloro-6-fluorophenyl)cyclopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.02477 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.03205 128.6
[M+Na]+ 209.01399 140.4
[M-H]- 185.01749 134.3
[M+NH4]+ 204.05859 146.0
[M+K]+ 224.98793 136.1
[M+H-H2O]+ 169.02203 123.7
[M+HCOO]- 231.02297 146.7
[M+CH3COO]- 245.03862 181.0
[M+Na-2H]- 206.99944 135.8
[M]+ 186.02422 131.2
[M]- 186.02532 131.2
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.