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

3
Patents

295.10693 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.114206 164.7
[M+Na]+ 318.096148 171.4
[M-H]- 294.099654 168.2
[M+NH4]+ 313.140753 174.3
[M+K]+ 334.070088 166.1
[M+H-H2O]+ 278.104190 153.3
[M+HCOO]- 340.105131 184.6
[M+CH3COO]- 354.120781 174.5
[M+Na-2H]- 316.081596 170.6
[M]+ 295.10638142 163.5
[M]- 295.10747858 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