CID 6481687

1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol

Structural Information

Molecular Formula
C10H10FN3O
SMILES
C1=CC(=CC=C1C(CN2N=CC=N2)O)F
InChI
InChI=1S/C10H10FN3O/c11-9-3-1-8(2-4-9)10(15)7-14-12-5-6-13-14/h1-6,10,15H,7H2
InChIKey
LOOXFJRZHHQNBU-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.0808 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.08808 142.2
[M+Na]+ 230.07002 150.7
[M-H]- 206.07352 142.6
[M+NH4]+ 225.11462 157.9
[M+K]+ 246.04396 147.2
[M+H-H2O]+ 190.07806 132.6
[M+HCOO]- 252.07900 161.4
[M+CH3COO]- 266.09465 182.2
[M+Na-2H]- 228.05547 146.9
[M]+ 207.08025 140.5
[M]- 207.08135 140.5
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.