CID 3047892

Benzhydryl 6-(morpholino)hexyl hydrochloride

Structural Information

Molecular Formula
C23H31NO2
SMILES
C1COCCN1CCCCCCOC(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H31NO2/c1(9-15-24-16-19-25-20-17-24)2-10-18-26-23(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-8,11-14,23H,1-2,9-10,15-20H2
InChIKey
DXCNBNRQUWWUCK-UHFFFAOYSA-N
Compound name
4-(6-benzhydryloxyhexyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.23547 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.242746 189.5
[M+Na]+ 376.224688 189.9
[M-H]- 352.228194 195.5
[M+NH4]+ 371.269293 198.0
[M+K]+ 392.198628 186.2
[M+H-H2O]+ 336.232730 178.0
[M+HCOO]- 398.233671 204.8
[M+CH3COO]- 412.249321 213.2
[M+Na-2H]- 374.210136 191.4
[M]+ 353.23492142 187.6
[M]- 353.23601858 187.6
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

No patent data available for this compound.