CID 32412

(2-aminoethyl)carbamic acid

Structural Information

Molecular Formula

C₃H₈N₂O₂

SMILES

C(CNC(=O)O)N

InChI

InChI=1S/C3H8N2O2/c4-1-2-5-3(6)7/h5H,1-2,4H2,(H,6,7)

InChIKey

RLRHPCKWSXWKBG-UHFFFAOYSA-N

Compound name

2-aminoethylcarbamic acid

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 2
References: 1368
Patents: 104.05858 Da
Monoisotopic Mass: -3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	105.06586	118.8
[M+Na]+	127.04780	126.3
[M+NH4]+	122.09240	125.5
[M+K]+	143.02174	123.2
[M-H]-	103.05130	117.7
[M+Na-2H]-	125.03325	121.5
[M]+	104.05803	119.0
[M]-	104.05913	119.0

Literature stripe

literature stripe

Patent stripe

patents stripe