CID 3047472

2-propen-1-aminium, n-(2-amino-2-oxoethyl)-n,n-dimethyl-

Structural Information

Molecular Formula
C7H15N2O
SMILES
C[N+](C)(CC=C)CC(=O)N
InChI
InChI=1S/C7H14N2O/c1-4-5-9(2,3)6-7(8)10/h4H,1,5-6H2,2-3H3,(H-,8,10)/p+1
InChIKey
HXZFCICQYDXOKJ-UHFFFAOYSA-O
Compound name
(2-amino-2-oxoethyl)-dimethyl-prop-2-enylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.11844 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.12572 127.7
[M+Na]+ 166.10766 134.1
[M-H]- 142.11116 129.3
[M+NH4]+ 161.15226 149.2
[M+K]+ 182.08160 128.5
[M+H-H2O]+ 126.11570 126.0
[M+HCOO]- 188.11664 151.8
[M+CH3COO]- 202.13229 175.9
[M+Na-2H]- 164.09311 136.2
[M]+ 143.11789 125.8
[M]- 143.11899 125.8
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