CID 24703589

2-chloro-n-ethyl-n-(2-methylprop-2-en-1-yl)propanamide

Structural Information

Molecular Formula
C9H16ClNO
SMILES
CCN(CC(=C)C)C(=O)C(C)Cl
InChI
InChI=1S/C9H16ClNO/c1-5-11(6-7(2)3)9(12)8(4)10/h8H,2,5-6H2,1,3-4H3
InChIKey
MXCLKCZZDWCTNJ-UHFFFAOYSA-N
Compound name
2-chloro-N-ethyl-N-(2-methylprop-2-enyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.09204 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.09932 143.0
[M+Na]+ 212.08126 149.2
[M-H]- 188.08476 144.5
[M+NH4]+ 207.12586 163.9
[M+K]+ 228.05520 147.9
[M+H-H2O]+ 172.08930 138.9
[M+HCOO]- 234.09024 160.7
[M+CH3COO]- 248.10589 190.5
[M+Na-2H]- 210.06671 143.9
[M]+ 189.09149 145.9
[M]- 189.09259 145.9
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.