CID 11205719

2,4-dimethylazetidine hydrochloride

Structural Information

Molecular Formula
C5H11N
SMILES
C[C@@H]1C[C@H](N1)C
InChI
InChI=1S/C5H11N/c1-4-3-5(2)6-4/h4-6H,3H2,1-2H3/t4-,5-/m1/s1
InChIKey
YPIDADKMTAZBST-RFZPGFLSSA-N
Compound name
(2R,4R)-2,4-dimethylazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

132
Patents

85.08915 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 86.096426 115.4
[M+Na]+ 108.07837 122.2
[M-H]- 84.081874 116.6
[M+NH4]+ 103.12297 131.2
[M+K]+ 124.05231 124.2
[M+H-H2O]+ 68.086410 105.8
[M+HCOO]- 130.08735 135.2
[M+CH3COO]- 144.10300 167.1
[M+Na-2H]- 106.06382 121.8
[M]+ 85.088601 121.2
[M]- 85.089699 121.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.