CID 155820101

3-(dimethylamino)-n-[(dimethylcarbamoyl)methyl]propanamide hydrochloride

Structural Information

Molecular Formula
C9H19N3O2
SMILES
CN(C)CCC(=O)NCC(=O)N(C)C
InChI
InChI=1S/C9H19N3O2/c1-11(2)6-5-8(13)10-7-9(14)12(3)4/h5-7H2,1-4H3,(H,10,13)
InChIKey
FNHJLYZQURTQAO-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-N-[2-(dimethylamino)-2-oxoethyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.14772 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.15500 149.5
[M+Na]+ 224.13694 153.4
[M-H]- 200.14044 152.3
[M+NH4]+ 219.18154 168.9
[M+K]+ 240.11088 155.9
[M+H-H2O]+ 184.14498 142.6
[M+HCOO]- 246.14592 175.2
[M+CH3COO]- 260.16157 200.6
[M+Na-2H]- 222.12239 151.5
[M]+ 201.14717 151.9
[M]- 201.14827 151.9
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

No patent data available for this compound.