CID 20785608

Cyclopropyl(4-fluoro-3-methylphenyl)methanol

Structural Information

Molecular Formula
C11H13FO
SMILES
CC1=C(C=CC(=C1)C(C2CC2)O)F
InChI
InChI=1S/C11H13FO/c1-7-6-9(4-5-10(7)12)11(13)8-2-3-8/h4-6,8,11,13H,2-3H2,1H3
InChIKey
YBUARYQDBOZGOK-UHFFFAOYSA-N
Compound name
cyclopropyl-(4-fluoro-3-methylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

180.09505 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.10233 141.0
[M+Na]+ 203.08427 154.1
[M+NH4]+ 198.12887 149.9
[M+K]+ 219.05821 149.4
[M-H]- 179.08777 149.6
[M+Na-2H]- 201.06972 149.9
[M]+ 180.09450 146.3
[M]- 180.09560 146.3
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