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

13
Patents

322.2045 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.211776 178.4
[M+Na]+ 345.193718 187.3
[M-H]- 321.197224 189.8
[M+NH4]+ 340.238323 194.8
[M+K]+ 361.167658 184.5
[M+H-H2O]+ 305.201760 169.7
[M+HCOO]- 367.202701 200.7
[M+CH3COO]- 381.218351 217.2
[M+Na-2H]- 343.179166 179.5
[M]+ 322.20395142 182.1
[M]- 322.20504858 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