CID 200915

4-(2-(diphenylamino)ethyl)-4-methyl-morpholinium bromide

Structural Information

Molecular Formula
C19H25N2O
SMILES
C[N+]1(CCOCC1)CCN(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H25N2O/c1-21(14-16-22-17-15-21)13-12-20(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11H,12-17H2,1H3/q+1
InChIKey
GXFURIRZNMWATO-UHFFFAOYSA-N
Compound name
N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-N-phenylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.1967 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.20398 173.1
[M+Na]+ 320.18592 175.6
[M-H]- 296.18942 181.8
[M+NH4]+ 315.23052 186.4
[M+K]+ 336.15986 167.7
[M+H-H2O]+ 280.19396 165.1
[M+HCOO]- 342.19490 191.6
[M+CH3COO]- 356.21055 199.9
[M+Na-2H]- 318.17137 181.1
[M]+ 297.19615 168.4
[M]- 297.19725 168.4
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.