CID 14549035

2-aminoethyl carbamate hydrochloride

Structural Information

Molecular Formula
C3H8N2O2
SMILES
C(COC(=O)N)N
InChI
InChI=1S/C3H8N2O2/c4-1-2-7-3(5)6/h1-2,4H2,(H2,5,6)
InChIKey
ZYFTZMADDQMCNB-UHFFFAOYSA-N
Compound name
2-aminoethyl carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

779
Patents

104.05858 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 105.06586 118.8
[M+Na]+ 127.04780 125.6
[M-H]- 103.05130 118.4
[M+NH4]+ 122.09240 140.6
[M+K]+ 143.02174 126.0
[M+H-H2O]+ 87.055840 113.7
[M+HCOO]- 149.05678 143.9
[M+CH3COO]- 163.07243 169.7
[M+Na-2H]- 125.03325 124.3
[M]+ 104.05803 116.6
[M]- 104.05913 116.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe