CID 17583

N,n-diethylacrylamide

Structural Information

Molecular Formula
C7H13NO
SMILES
CCN(CC)C(=O)C=C
InChI
InChI=1S/C7H13NO/c1-4-7(9)8(5-2)6-3/h4H,1,5-6H2,2-3H3
InChIKey
OVHHHVAVHBHXAK-UHFFFAOYSA-N
Compound name
N,N-diethylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

44
References

26121
Patents

127.09972 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 127.8
[M+Na]+ 150.088938 134.4
[M-H]- 126.092444 129.6
[M+NH4]+ 145.133543 150.5
[M+K]+ 166.062878 135.1
[M+H-H2O]+ 110.096980 122.9
[M+HCOO]- 172.097921 152.5
[M+CH3COO]- 186.113571 178.8
[M+Na-2H]- 148.074386 132.7
[M]+ 127.09917142 129.3
[M]- 127.10026858 129.3
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