CID 212267

O-anisanilide, alpha-1h-tetrazol-5-yl-

Structural Information

Molecular Formula
C15H13N5O2
SMILES
C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2OCC3=NNN=N3
InChI
InChI=1S/C15H13N5O2/c21-15(16-11-6-2-1-3-7-11)12-8-4-5-9-13(12)22-10-14-17-19-20-18-14/h1-9H,10H2,(H,16,21)(H,17,18,19,20)
InChIKey
XIZIAPDKVDKLKH-UHFFFAOYSA-N
Compound name
N-phenyl-2-(2H-tetrazol-5-ylmethoxy)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

295.10693 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.11421 164.7
[M+Na]+ 318.09615 171.4
[M-H]- 294.09965 168.2
[M+NH4]+ 313.14075 174.3
[M+K]+ 334.07009 166.1
[M+H-H2O]+ 278.10419 153.3
[M+HCOO]- 340.10513 184.6
[M+CH3COO]- 354.12078 174.5
[M+Na-2H]- 316.08160 170.6
[M]+ 295.10638 163.5
[M]- 295.10748 163.5
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

patents stripe