CID 4685895

N-ethyl-ortho-methacrylotoluidide

Structural Information

Molecular Formula
C13H17NO
SMILES
CCN(C1=CC=CC=C1C)C(=O)C(=C)C
InChI
InChI=1S/C13H17NO/c1-5-14(13(15)10(2)3)12-9-7-6-8-11(12)4/h6-9H,2,5H2,1,3-4H3
InChIKey
IFDHZHUTMRJWHT-UHFFFAOYSA-N
Compound name
N-ethyl-2-methyl-N-(2-methylphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.13101 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.138286 146.9
[M+Na]+ 226.120228 153.0
[M-H]- 202.123734 151.8
[M+NH4]+ 221.164833 166.4
[M+K]+ 242.094168 151.8
[M+H-H2O]+ 186.128270 140.5
[M+HCOO]- 248.129211 170.3
[M+CH3COO]- 262.144861 194.2
[M+Na-2H]- 224.105676 149.4
[M]+ 203.13046142 147.9
[M]- 203.13155858 147.9
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.