CID 57999543

1,3-dimethylazetidin-3-amine dihydrochloride

Structural Information

Molecular Formula
C5H12N2
SMILES
CC1(CN(C1)C)N
InChI
InChI=1S/C5H12N2/c1-5(6)3-7(2)4-5/h3-4,6H2,1-2H3
InChIKey
SRKFECRKKOZICT-UHFFFAOYSA-N
Compound name
1,3-dimethylazetidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

100.10005 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.107326 121.5
[M+Na]+ 123.089268 128.4
[M-H]- 99.092774 123.8
[M+NH4]+ 118.133873 138.7
[M+K]+ 139.063208 131.0
[M+H-H2O]+ 83.097310 112.1
[M+HCOO]- 145.098251 143.0
[M+CH3COO]- 159.113901 173.2
[M+Na-2H]- 121.074716 128.2
[M]+ 100.09950142 127.5
[M]- 100.10059858 127.5
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