CID 3021423

Morpholine, 4-benzyl-2-(benzyloxy)-, hydrochloride

Structural Information

Molecular Formula
C18H21NO2
SMILES
C1COC(CN1CC2=CC=CC=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C18H21NO2/c1-3-7-16(8-4-1)13-19-11-12-20-18(14-19)21-15-17-9-5-2-6-10-17/h1-10,18H,11-15H2
InChIKey
VXRVKSMHBLRCOB-UHFFFAOYSA-N
Compound name
4-benzyl-2-phenylmethoxymorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

283.15723 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.16451 167.1
[M+Na]+ 306.14645 171.0
[M-H]- 282.14995 174.5
[M+NH4]+ 301.19105 179.1
[M+K]+ 322.12039 168.0
[M+H-H2O]+ 266.15449 156.8
[M+HCOO]- 328.15543 185.2
[M+CH3COO]- 342.17108 177.2
[M+Na-2H]- 304.13190 172.3
[M]+ 283.15668 164.6
[M]- 283.15778 164.6
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

patents stripe