CID 214438

4,5-diphenyl-2-(2-(isopropylamino)ethyl)oxazole monohydrochloride

Structural Information

Molecular Formula
C20H22N2O
SMILES
CC(C)NCCC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H22N2O/c1-15(2)21-14-13-18-22-19(16-9-5-3-6-10-16)20(23-18)17-11-7-4-8-12-17/h3-12,15,21H,13-14H2,1-2H3
InChIKey
LEOFSQDUPTZCFB-UHFFFAOYSA-N
Compound name
N-[2-(4,5-diphenyl-1,3-oxazol-2-yl)ethyl]propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

306.17322 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.180496 174.8
[M+Na]+ 329.162438 180.8
[M-H]- 305.165944 183.7
[M+NH4]+ 324.207043 188.1
[M+K]+ 345.136378 176.7
[M+H-H2O]+ 289.170480 165.3
[M+HCOO]- 351.171421 197.3
[M+CH3COO]- 365.187071 185.9
[M+Na-2H]- 327.147886 177.8
[M]+ 306.17267142 176.1
[M]- 306.17376858 176.1
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