CID 532184

(2-bromophenyl)(morpholino)methanone

Structural Information

Molecular Formula
C11H12BrNO2
SMILES
C1COCCN1C(=O)C2=CC=CC=C2Br
InChI
InChI=1S/C11H12BrNO2/c12-10-4-2-1-3-9(10)11(14)13-5-7-15-8-6-13/h1-4H,5-8H2
InChIKey
QPQCGIYRAMNHKH-UHFFFAOYSA-N
Compound name
(2-bromophenyl)-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

269.00513 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.01241 152.2
[M+Na]+ 291.99435 160.9
[M-H]- 267.99785 159.9
[M+NH4]+ 287.03895 169.3
[M+K]+ 307.96829 151.8
[M+H-H2O]+ 252.00239 151.1
[M+HCOO]- 314.00333 168.5
[M+CH3COO]- 328.01898 191.1
[M+Na-2H]- 289.97980 158.6
[M]+ 269.00458 167.8
[M]- 269.00568 167.8
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