CID 36345

33161-67-0

Structural Information

Molecular Formula
C19H18N2O2
SMILES
CC(=O)N(C)CC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H18N2O2/c1-14(22)21(2)13-17-20-18(15-9-5-3-6-10-15)19(23-17)16-11-7-4-8-12-16/h3-12H,13H2,1-2H3
InChIKey
PFBOXUSIVQIJBC-UHFFFAOYSA-N
Compound name
N-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl]-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

306.13684 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.14412 173.0
[M+Na]+ 329.12606 179.8
[M-H]- 305.12956 183.8
[M+NH4]+ 324.17066 186.9
[M+K]+ 345.10000 177.5
[M+H-H2O]+ 289.13410 163.5
[M+HCOO]- 351.13504 196.8
[M+CH3COO]- 365.15069 209.4
[M+Na-2H]- 327.11151 175.9
[M]+ 306.13629 175.9
[M]- 306.13739 175.9
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

patents stripe