CID 204439

N-(alpha-(1-methyl-1-morpholinoethyl)benzilidene)benzamide, monohydrochloride

Structural Information

Molecular Formula
C21H24N2O2
SMILES
CC(C)(C(=NC(=O)C1=CC=CC=C1)C2=CC=CC=C2)N3CCOCC3
InChI
InChI=1S/C21H24N2O2/c1-21(2,23-13-15-25-16-14-23)19(17-9-5-3-6-10-17)22-20(24)18-11-7-4-8-12-18/h3-12H,13-16H2,1-2H3
InChIKey
GEEIXTQTVOSJPD-UHFFFAOYSA-N
Compound name
N-(2-methyl-2-morpholin-4-yl-1-phenylpropylidene)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.18378 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.19106 181.7
[M+Na]+ 359.17300 183.5
[M-H]- 335.17650 190.1
[M+NH4]+ 354.21760 191.4
[M+K]+ 375.14694 181.1
[M+H-H2O]+ 319.18104 171.2
[M+HCOO]- 381.18198 198.1
[M+CH3COO]- 395.19763 213.3
[M+Na-2H]- 357.15845 185.6
[M]+ 336.18323 177.9
[M]- 336.18433 177.9
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.