CID 25159190

2,2-dimethylazetidine

Structural Information

Molecular Formula
C5H11N
SMILES
CC1(CCN1)C
InChI
InChI=1S/C5H11N/c1-5(2)3-4-6-5/h6H,3-4H2,1-2H3
InChIKey
KTHMOBNDGBTCLB-UHFFFAOYSA-N
Compound name
2,2-dimethylazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

228
Patents

85.08915 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 86.096426 116.7
[M+Na]+ 108.07837 123.4
[M-H]- 84.081874 118.0
[M+NH4]+ 103.12297 134.2
[M+K]+ 124.05231 125.5
[M+H-H2O]+ 68.086410 108.1
[M+HCOO]- 130.08735 136.5
[M+CH3COO]- 144.10300 165.6
[M+Na-2H]- 106.06382 124.7
[M]+ 85.088601 122.4
[M]- 85.089699 122.4
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

patents stripe