CID 60809013

2-chloro-n-(2-methylpropyl)-n-(propan-2-yl)acetamide

Structural Information

Molecular Formula
C9H18ClNO
SMILES
CC(C)CN(C(C)C)C(=O)CCl
InChI
InChI=1S/C9H18ClNO/c1-7(2)6-11(8(3)4)9(12)5-10/h7-8H,5-6H2,1-4H3
InChIKey
NSOZCRVCADMVSW-UHFFFAOYSA-N
Compound name
2-chloro-N-(2-methylpropyl)-N-propan-2-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.1077 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.11498 144.6
[M+Na]+ 214.09692 150.5
[M-H]- 190.10042 146.1
[M+NH4]+ 209.14152 165.5
[M+K]+ 230.07086 149.8
[M+H-H2O]+ 174.10496 140.4
[M+HCOO]- 236.10590 162.0
[M+CH3COO]- 250.12155 191.4
[M+Na-2H]- 212.08237 145.4
[M]+ 191.10715 148.2
[M]- 191.10825 148.2
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.