CID 75480679

2-azido-3-phenylpropanamide

Structural Information

Molecular Formula

C₉H₁₀N₄O

SMILES

C1=CC=C(C=C1)CC(C(=O)N)N=[N+]=[N-]

InChI

InChI=1S/C9H10N4O/c10-9(14)8(12-13-11)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H2,10,14)

InChIKey

OSZORJXDLKSMFZ-UHFFFAOYSA-N

Compound name

2-azido-3-phenylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 190.08546 Da
Monoisotopic Mass: 2.2
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]+	191.09274	139.7
[M+Na]+	213.07468	150.4
[M+NH4]+	208.11928	147.6
[M+K]+	229.04862	146.6
[M-H]-	189.07818	144.9
[M+Na-2H]-	211.06013	146.8
[M]+	190.08491	142.2
[M]-	190.08601	142.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe