CID 3061440

79213-92-6

Structural Information

Molecular Formula
C21H26N2O
SMILES
CC1=CC(=CC(=C1C2C(=NC(O2)(C)C)C3=CC=CC=C3)C)N(C)C
InChI
InChI=1S/C21H26N2O/c1-14-12-17(23(5)6)13-15(2)18(14)20-19(22-21(3,4)24-20)16-10-8-7-9-11-16/h7-13,20H,1-6H3
InChIKey
DVCKFBTUXYEUIO-UHFFFAOYSA-N
Compound name
4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N,3,5-tetramethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

322.2045 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.21178 178.4
[M+Na]+ 345.19372 187.3
[M-H]- 321.19722 189.8
[M+NH4]+ 340.23832 194.8
[M+K]+ 361.16766 184.5
[M+H-H2O]+ 305.20176 169.7
[M+HCOO]- 367.20270 200.7
[M+CH3COO]- 381.21835 217.2
[M+Na-2H]- 343.17917 179.5
[M]+ 322.20395 182.1
[M]- 322.20505 182.1
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