CID 214426

33161-83-0

Structural Information

Molecular Formula
C22H26N2O3
SMILES
CC(CN(CC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3)CC(C)O)O
InChI
InChI=1S/C22H26N2O3/c1-16(25)13-24(14-17(2)26)15-20-23-21(18-9-5-3-6-10-18)22(27-20)19-11-7-4-8-12-19/h3-12,16-17,25-26H,13-15H2,1-2H3
InChIKey
ZWAXWBOAVGGUPF-UHFFFAOYSA-N
Compound name
1-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl-(2-hydroxypropyl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

366.19434 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.201616 190.4
[M+Na]+ 389.183558 193.9
[M-H]- 365.187064 197.9
[M+NH4]+ 384.228163 200.1
[M+K]+ 405.157498 191.2
[M+H-H2O]+ 349.191600 180.7
[M+HCOO]- 411.192541 209.0
[M+CH3COO]- 425.208191 217.9
[M+Na-2H]- 387.169006 189.8
[M]+ 366.19379142 192.2
[M]- 366.19488858 192.2
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