CID 54592469

2-chloro-n-cyclopropyl-n-(2-methylpropyl)acetamide

Structural Information

Molecular Formula
C9H16ClNO
SMILES
CC(C)CN(C1CC1)C(=O)CCl
InChI
InChI=1S/C9H16ClNO/c1-7(2)6-11(8-3-4-8)9(12)5-10/h7-8H,3-6H2,1-2H3
InChIKey
OMTVSBIQZKYGHC-UHFFFAOYSA-N
Compound name
2-chloro-N-cyclopropyl-N-(2-methylpropyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.09204 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.09932 138.6
[M+Na]+ 212.08126 149.8
[M+NH4]+ 207.12586 147.4
[M+K]+ 228.05520 146.1
[M-H]- 188.08476 146.7
[M+Na-2H]- 210.06671 145.7
[M]+ 189.09149 143.6
[M]- 189.09259 143.6
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.