CID 22633334

501126-02-9

Structural Information

Molecular Formula
C8H8N4O
SMILES
C1=CC(=CC=C1CO)C2=NNN=N2
InChI
InChI=1S/C8H8N4O/c13-5-6-1-3-7(4-2-6)8-9-11-12-10-8/h1-4,13H,5H2,(H,9,10,11,12)
InChIKey
YRBYIQONKVQONA-UHFFFAOYSA-N
Compound name
[4-(2H-tetrazol-5-yl)phenyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

176.06981 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.07709 136.6
[M+Na]+ 199.05903 149.5
[M+NH4]+ 194.10363 143.2
[M+K]+ 215.03297 146.0
[M-H]- 175.06253 136.9
[M+Na-2H]- 197.04448 144.2
[M]+ 176.06926 138.3
[M]- 176.07036 138.3
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