CID 61955221

2-chloro-1-(2,2,6-trimethylmorpholin-4-yl)ethan-1-one

Structural Information

Molecular Formula
C9H16ClNO2
SMILES
CC1CN(CC(O1)(C)C)C(=O)CCl
InChI
InChI=1S/C9H16ClNO2/c1-7-5-11(8(12)4-10)6-9(2,3)13-7/h7H,4-6H2,1-3H3
InChIKey
ZPOUARKIZOSMFF-UHFFFAOYSA-N
Compound name
2-chloro-1-(2,2,6-trimethylmorpholin-4-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.08696 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.09424 141.9
[M+Na]+ 228.07618 149.9
[M-H]- 204.07968 144.6
[M+NH4]+ 223.12078 161.6
[M+K]+ 244.05012 148.8
[M+H-H2O]+ 188.08422 137.5
[M+HCOO]- 250.08516 155.1
[M+CH3COO]- 264.10081 184.1
[M+Na-2H]- 226.06163 146.4
[M]+ 205.08641 143.1
[M]- 205.08751 143.1
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.