CID 10336591

N-ethylazetidin-3-amine dihydrochloride

Structural Information

Molecular Formula
C5H12N2
SMILES
CCNC1CNC1
InChI
InChI=1S/C5H12N2/c1-2-7-5-3-6-4-5/h5-7H,2-4H2,1H3
InChIKey
QLBGCEBVDMZPPN-UHFFFAOYSA-N
Compound name
N-ethylazetidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

106
Patents

100.10005 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.107326 120.9
[M+Na]+ 123.089268 125.6
[M-H]- 99.092774 121.5
[M+NH4]+ 118.133873 135.3
[M+K]+ 139.063208 127.6
[M+H-H2O]+ 83.097310 109.9
[M+HCOO]- 145.098251 141.5
[M+CH3COO]- 159.113901 170.6
[M+Na-2H]- 121.074716 127.9
[M]+ 100.09950142 125.4
[M]- 100.10059858 125.4
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