CID 13379937

[2-(trifluoromethyl)cyclopropyl]methanol

Structural Information

Molecular Formula
C5H7F3O
SMILES
C1C(C1C(F)(F)F)CO
InChI
InChI=1S/C5H7F3O/c6-5(7,8)4-1-3(4)2-9/h3-4,9H,1-2H2
InChIKey
YZAYHNYHJCPNAR-UHFFFAOYSA-N
Compound name
[2-(trifluoromethyl)cyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

140.0449 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.05218 134.8
[M+Na]+ 163.03412 142.6
[M+NH4]+ 158.07872 140.8
[M+K]+ 179.00806 140.3
[M-H]- 139.03762 136.6
[M+Na-2H]- 161.01957 139.1
[M]+ 140.04435 136.9
[M]- 140.04545 136.9
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