CID 49128

N,n-diphenylcarbamic acid (2-morpholinoethyl) ester, hydrochloride

Structural Information

Molecular Formula
C19H22N2O3
SMILES
C1COCCN1CCOC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H22N2O3/c22-19(24-16-13-20-11-14-23-15-12-20)21(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10H,11-16H2
InChIKey
WYSZPUYBJPHYML-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl N,N-diphenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.16306 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.17034 177.6
[M+Na]+ 349.15228 179.3
[M-H]- 325.15578 186.0
[M+NH4]+ 344.19688 187.6
[M+K]+ 365.12622 178.0
[M+H-H2O]+ 309.16032 166.4
[M+HCOO]- 371.16126 196.2
[M+CH3COO]- 385.17691 209.8
[M+Na-2H]- 347.13773 181.6
[M]+ 326.16251 175.6
[M]- 326.16361 175.6
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.