CID 12674607

3,3-dimethylazetidine hydrochloride

Structural Information

Molecular Formula
C5H11N
SMILES
CC1(CNC1)C
InChI
InChI=1S/C5H11N/c1-5(2)3-6-4-5/h6H,3-4H2,1-2H3
InChIKey
RLVVIGIYIMDCAU-UHFFFAOYSA-N
Compound name
3,3-dimethylazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

877
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 116.7
[M+Na]+ 108.078368 123.4
[M-H]- 84.081874 118.0
[M+NH4]+ 103.122973 134.2
[M+K]+ 124.052308 125.5
[M+H-H2O]+ 68.086410 108.1
[M+HCOO]- 130.087351 136.5
[M+CH3COO]- 144.103001 165.6
[M+Na-2H]- 106.063816 124.7
[M]+ 85.08860142 122.4
[M]- 85.08969858 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