CID 81619079

1-[2-bromo-5-(trifluoromethyl)phenyl]cyclopropan-1-ol

Structural Information

Molecular Formula
C10H8BrF3O
SMILES
C1CC1(C2=C(C=CC(=C2)C(F)(F)F)Br)O
InChI
InChI=1S/C10H8BrF3O/c11-8-2-1-6(10(12,13)14)5-7(8)9(15)3-4-9/h1-2,5,15H,3-4H2
InChIKey
HMNCHWXCKVKIBK-UHFFFAOYSA-N
Compound name
1-[2-bromo-5-(trifluoromethyl)phenyl]cyclopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.97107 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.97835 157.7
[M+Na]+ 302.96029 159.8
[M+NH4]+ 298.00489 162.1
[M+K]+ 318.93423 159.8
[M-H]- 278.96379 160.4
[M+Na-2H]- 300.94574 162.4
[M]+ 279.97052 158.6
[M]- 279.97162 158.6
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.