CID 2697536

143579-17-3

Structural Information

Molecular Formula
C12H15BrN2O2
SMILES
C1COCCN1CC(=O)NC2=CC=CC=C2Br
InChI
InChI=1S/C12H15BrN2O2/c13-10-3-1-2-4-11(10)14-12(16)9-15-5-7-17-8-6-15/h1-4H,5-9H2,(H,14,16)
InChIKey
XCXBNQCEWOPMAZ-UHFFFAOYSA-N
Compound name
N-(2-bromophenyl)-2-morpholin-4-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

298.03168 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.038956 160.4
[M+Na]+ 321.020898 167.7
[M-H]- 297.024404 167.7
[M+NH4]+ 316.065503 175.9
[M+K]+ 336.994838 157.9
[M+H-H2O]+ 281.028940 158.1
[M+HCOO]- 343.029881 177.2
[M+CH3COO]- 357.045531 198.6
[M+Na-2H]- 319.006346 166.5
[M]+ 298.03113142 175.6
[M]- 298.03222858 175.6
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

patents stripe