CID 44095

Alpha,alpha-dicyclopropyl-4-fluorobenzyl alcohol

Structural Information

Molecular Formula
C13H15FO
SMILES
C1CC1C(C2CC2)(C3=CC=C(C=C3)F)O
InChI
InChI=1S/C13H15FO/c14-12-7-5-11(6-8-12)13(15,9-1-2-9)10-3-4-10/h5-10,15H,1-4H2
InChIKey
UZLKOZBJNPWGSK-UHFFFAOYSA-N
Compound name
dicyclopropyl-(4-fluorophenyl)methanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

206.11069 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11797 144.2
[M+Na]+ 229.09991 151.3
[M-H]- 205.10341 151.5
[M+NH4]+ 224.14451 151.4
[M+K]+ 245.07385 148.9
[M+H-H2O]+ 189.10795 137.7
[M+HCOO]- 251.10889 162.1
[M+CH3COO]- 265.12454 196.3
[M+Na-2H]- 227.08536 148.5
[M]+ 206.11014 145.3
[M]- 206.11124 145.3
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