CID 11116171

5-azidopentanoic acid

Structural Information

Molecular Formula

C₅H₉N₃O₂

SMILES

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

InChI

InChI=1S/C5H9N3O2/c6-8-7-4-2-1-3-5(9)10/h1-4H2,(H,9,10)

InChIKey

SBZDIRMBQJDCLB-UHFFFAOYSA-N

Compound name

5-azidopentanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 909
Patents: 143.06947 Da
Monoisotopic Mass: 1.3
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]+	144.07675	128.0
[M+Na]+	166.05869	137.5
[M+NH4]+	161.10329	135.2
[M+K]+	182.03263	134.5
[M-H]-	142.06219	129.6
[M+Na-2H]-	164.04414	132.0
[M]+	143.06892	129.3
[M]-	143.07002	129.3

Literature stripe

literature stripe

Patent stripe

patents stripe