CID 58114323

1037798-26-7

Structural Information

Molecular Formula
C7H5FN4O
SMILES
C1=CC(=C(C=C1N2C=NN=N2)F)O
InChI
InChI=1S/C7H5FN4O/c8-6-3-5(1-2-7(6)13)12-4-9-10-11-12/h1-4,13H
InChIKey
FTESLVUXEDIYKX-UHFFFAOYSA-N
Compound name
2-fluoro-4-(tetrazol-1-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

180.04474 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.05202 133.4
[M+Na]+ 203.03396 144.6
[M-H]- 179.03746 133.2
[M+NH4]+ 198.07856 149.2
[M+K]+ 219.00790 140.9
[M+H-H2O]+ 163.04200 123.8
[M+HCOO]- 225.04294 153.2
[M+CH3COO]- 239.05859 146.3
[M+Na-2H]- 201.01941 139.9
[M]+ 180.04419 132.2
[M]- 180.04529 132.2
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