CID 165437649

914465-63-7

Structural Information

Molecular Formula

C₁₆H₁₅N₅O₂

SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)CNC(=O)CO)C3=NNN=N3

InChI

InChI=1S/C16H15N5O2/c22-10-15(23)17-9-11-5-7-12(8-6-11)13-3-1-2-4-14(13)16-18-20-21-19-16/h1-8,22H,9-10H2,(H,17,23)(H,18,19,20,21)

InChIKey

VNDVJEIVQNHFMW-UHFFFAOYSA-N

Compound name

2-hydroxy-N-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 309.1226 Da
Monoisotopic Mass: 1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	310.129876	170.1
[M+Na]+	332.111818	176.9
[M-H]-	308.115324	172.5
[M+NH4]+	327.156423	178.8
[M+K]+	348.085758	170.5
[M+H-H2O]+	292.119860	159.2
[M+HCOO]-	354.120801	188.2
[M+CH3COO]-	368.136451	179.2
[M+Na-2H]-	330.097266	174.3
[M]+	309.12205142	167.9
[M]-	309.12314858	167.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.