CID 11116327

10196-26-6

Structural Information

Molecular Formula
C7H13NO3
SMILES
C=CC(=O)N(CCO)CCO
InChI
InChI=1S/C7H13NO3/c1-2-7(11)8(3-5-9)4-6-10/h2,9-10H,1,3-6H2
InChIKey
XUQIDBSIIKXTTI-UHFFFAOYSA-N
Compound name
N,N-bis(2-hydroxyethyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1141
Patents

159.08954 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.096816 135.2
[M+Na]+ 182.078758 140.8
[M-H]- 158.082264 133.9
[M+NH4]+ 177.123363 154.9
[M+K]+ 198.052698 140.5
[M+H-H2O]+ 142.086800 130.1
[M+HCOO]- 204.087741 157.3
[M+CH3COO]- 218.103391 177.6
[M+Na-2H]- 180.064206 138.8
[M]+ 159.08899142 135.6
[M]- 159.09008858 135.6
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