CID 66026328

{1-[(4-fluorophenyl)methyl]cyclopropyl}methanol

Structural Information

Molecular Formula
C11H13FO
SMILES
C1CC1(CC2=CC=C(C=C2)F)CO
InChI
InChI=1S/C11H13FO/c12-10-3-1-9(2-4-10)7-11(8-13)5-6-11/h1-4,13H,5-8H2
InChIKey
ZMYSHCXWFHJOIL-UHFFFAOYSA-N
Compound name
[1-[(4-fluorophenyl)methyl]cyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.09505 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.10233 134.3
[M+Na]+ 203.08427 144.0
[M-H]- 179.08777 139.7
[M+NH4]+ 198.12887 150.9
[M+K]+ 219.05821 141.1
[M+H-H2O]+ 163.09231 128.1
[M+HCOO]- 225.09325 156.2
[M+CH3COO]- 239.10890 182.0
[M+Na-2H]- 201.06972 141.5
[M]+ 180.09450 135.4
[M]- 180.09560 135.4
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.