CID 11644540

Acetamide, 2,2-dichloro-n-(1,3-dioxolan-2-ylmethyl)-n-2-propen-1-yl-

Structural Information

Molecular Formula
C9H13Cl2NO3
SMILES
C=CCN(CC1OCCO1)C(=O)C(Cl)Cl
InChI
InChI=1S/C9H13Cl2NO3/c1-2-3-12(9(13)8(10)11)6-7-14-4-5-15-7/h2,7-8H,1,3-6H2
InChIKey
OISQRMLHYOLTJL-UHFFFAOYSA-N
Compound name
2,2-dichloro-N-(1,3-dioxolan-2-ylmethyl)-N-prop-2-enylacetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2127
Patents

253.02725 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.034526 158.6
[M+Na]+ 276.016468 164.2
[M-H]- 252.019974 163.2
[M+NH4]+ 271.061073 175.8
[M+K]+ 291.990408 163.2
[M+H-H2O]+ 236.024510 154.1
[M+HCOO]- 298.025451 169.7
[M+CH3COO]- 312.041101 194.4
[M+Na-2H]- 274.001916 159.9
[M]+ 253.02670142 162.3
[M]- 253.02779858 162.3
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