CID 121552497

3-(azidomethyl)azetidine hydrochloride

Structural Information

Molecular Formula

C₄H₈N₄

SMILES

C1C(CN1)CN=[N+]=[N-]

InChI

InChI=1S/C4H8N4/c5-8-7-3-4-1-6-2-4/h4,6H,1-3H2

InChIKey

SBMPMMCWLNFXAV-UHFFFAOYSA-N

Compound name

3-(azidomethyl)azetidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 112.0749 Da
Monoisotopic Mass: 0.7
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]+	113.08218	121.5
[M+Na]+	135.06412	127.6
[M+NH4]+	130.10872	126.1
[M+K]+	151.03806	125.7
[M-H]-	111.06762	122.4
[M+Na-2H]-	133.04957	125.2
[M]+	112.07435	121.0
[M]-	112.07545	121.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.