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

107
Patents

100.10005 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.10733 120.9
[M+Na]+ 123.08927 125.6
[M-H]- 99.092774 121.5
[M+NH4]+ 118.13387 135.3
[M+K]+ 139.06321 127.6
[M+H-H2O]+ 83.097310 109.9
[M+HCOO]- 145.09825 141.5
[M+CH3COO]- 159.11390 170.6
[M+Na-2H]- 121.07472 127.9
[M]+ 100.09950 125.4
[M]- 100.10060 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