CID 6485064

3-(morpholine-4-carbonyl)aniline

Structural Information

Molecular Formula
C11H14N2O2
SMILES
C1COCCN1C(=O)C2=CC(=CC=C2)N
InChI
InChI=1S/C11H14N2O2/c12-10-3-1-2-9(8-10)11(14)13-4-6-15-7-5-13/h1-3,8H,4-7,12H2
InChIKey
RFFVEVKGZGRRCP-UHFFFAOYSA-N
Compound name
(3-aminophenyl)-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

214
Patents

206.10553 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11281 146.0
[M+Na]+ 229.09475 151.0
[M-H]- 205.09825 150.8
[M+NH4]+ 224.13935 161.2
[M+K]+ 245.06869 149.8
[M+H-H2O]+ 189.10279 137.9
[M+HCOO]- 251.10373 164.9
[M+CH3COO]- 265.11938 185.5
[M+Na-2H]- 227.08020 150.9
[M]+ 206.10498 141.0
[M]- 206.10608 141.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe