CID 1485330

3-fluoro-4-morpholinoaniline

Structural Information

Molecular Formula
C10H13FN2O
SMILES
C1COCCN1C2=C(C=C(C=C2)N)F
InChI
InChI=1S/C10H13FN2O/c11-9-7-8(12)1-2-10(9)13-3-5-14-6-4-13/h1-2,7H,3-6,12H2
InChIKey
FQGIBHQUVCGEAC-UHFFFAOYSA-N
Compound name
3-fluoro-4-morpholin-4-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

825
Patents

196.1012 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.108476 142.1
[M+Na]+ 219.090418 148.6
[M-H]- 195.093924 146.0
[M+NH4]+ 214.135023 158.1
[M+K]+ 235.064358 146.6
[M+H-H2O]+ 179.098460 133.4
[M+HCOO]- 241.099401 160.8
[M+CH3COO]- 255.115051 184.8
[M+Na-2H]- 217.075866 147.4
[M]+ 196.10065142 136.0
[M]- 196.10174858 136.0
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