CID 24710380

2-chloro-n,n-bis(prop-2-en-1-yl)propanamide

Structural Information

Molecular Formula
C9H14ClNO
SMILES
CC(C(=O)N(CC=C)CC=C)Cl
InChI
InChI=1S/C9H14ClNO/c1-4-6-11(7-5-2)9(12)8(3)10/h4-5,8H,1-2,6-7H2,3H3
InChIKey
MDULRZHSTPYALN-UHFFFAOYSA-N
Compound name
2-chloro-N,N-bis(prop-2-enyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.07639 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.08367 141.9
[M+Na]+ 210.06561 148.5
[M-H]- 186.06911 143.3
[M+NH4]+ 205.11021 162.8
[M+K]+ 226.03955 146.1
[M+H-H2O]+ 170.07365 137.6
[M+HCOO]- 232.07459 160.6
[M+CH3COO]- 246.09024 188.6
[M+Na-2H]- 208.05106 144.0
[M]+ 187.07584 144.6
[M]- 187.07694 144.6
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.