CID 84106835

2,2,3-trimethylazetidine hydrochloride

Structural Information

Molecular Formula

C₆H₁₃N

SMILES

CC1CNC1(C)C

InChI

InChI=1S/C6H13N/c1-5-4-7-6(5,2)3/h5,7H,4H2,1-3H3

InChIKey

HNIFLEDIIDJDLD-UHFFFAOYSA-N

Compound name

2,2,3-trimethylazetidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 99.1048 Da
Monoisotopic Mass: 1.0
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]+	100.112076	120.9
[M+Na]+	122.094018	128.1
[M-H]-	98.097524	122.4
[M+NH4]+	117.138623	138.2
[M+K]+	138.067958	129.9
[M+H-H2O]+	82.102060	112.4
[M+HCOO]-	144.103001	140.4
[M+CH3COO]-	158.118651	169.6
[M+Na-2H]-	120.079466	127.7
[M]+	99.10425142	127.3
[M]-	99.10534858	127.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.