CID 3076632

(1r,2'r)-1-phenyl-2-((morpholin-2-yl)methoxy)ethanol oxalate

Structural Information

Molecular Formula
C13H19NO3
SMILES
C1CO[C@H](CN1)COC[C@@H](C2=CC=CC=C2)O
InChI
InChI=1S/C13H19NO3/c15-13(11-4-2-1-3-5-11)10-16-9-12-8-14-6-7-17-12/h1-5,12-15H,6-10H2/t12-,13+/m1/s1
InChIKey
DWFJZBRYOXLXHU-OLZOCXBDSA-N
Compound name
(1R)-2-[[(2R)-morpholin-2-yl]methoxy]-1-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

237.13649 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.14377 155.8
[M+Na]+ 260.12571 166.5
[M+NH4]+ 255.17031 162.9
[M+K]+ 276.09965 161.0
[M-H]- 236.12921 159.1
[M+Na-2H]- 258.11116 161.1
[M]+ 237.13594 158.0
[M]- 237.13704 158.0
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