CID 11149633

N-[3-[3-(dimethylamino)-1-oxo-2-propenyl]phenyl]-n-ethylacetamide

Structural Information

Molecular Formula
C15H20N2O2
SMILES
CCN(C1=CC=CC(=C1)C(=O)/C=C/N(C)C)C(=O)C
InChI
InChI=1S/C15H20N2O2/c1-5-17(12(2)18)14-8-6-7-13(11-14)15(19)9-10-16(3)4/h6-11H,5H2,1-4H3/b10-9+
InChIKey
UXWJJVRASIHSQS-MDZDMXLPSA-N
Compound name
N-[3-[(E)-3-(dimethylamino)prop-2-enoyl]phenyl]-N-ethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

87
Patents

260.15247 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.15975 162.7
[M+Na]+ 283.14169 167.5
[M-H]- 259.14519 168.7
[M+NH4]+ 278.18629 180.1
[M+K]+ 299.11563 167.2
[M+H-H2O]+ 243.14973 155.1
[M+HCOO]- 305.15067 187.4
[M+CH3COO]- 319.16632 209.2
[M+Na-2H]- 281.12714 163.7
[M]+ 260.15192 165.6
[M]- 260.15302 165.6
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