CID 3061438

3-oxazoline, 2,2-dimethyl-5-(p-(dimethylamino)phenyl)-4-o-tolyl-

Structural Information

Molecular Formula
C20H24N2O
SMILES
CC1=CC=CC=C1C2=NC(OC2C3=CC=C(C=C3)N(C)C)(C)C
InChI
InChI=1S/C20H24N2O/c1-14-8-6-7-9-17(14)18-19(23-20(2,3)21-18)15-10-12-16(13-11-15)22(4)5/h6-13,19H,1-5H3
InChIKey
ZKBSCRTYFAFAQY-UHFFFAOYSA-N
Compound name
4-[2,2-dimethyl-4-(2-methylphenyl)-5H-1,3-oxazol-5-yl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

308.18887 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.19615 174.4
[M+Na]+ 331.17809 189.5
[M+NH4]+ 326.22269 184.7
[M+K]+ 347.15203 181.5
[M-H]- 307.18159 182.9
[M+Na-2H]- 329.16354 185.2
[M]+ 308.18832 179.4
[M]- 308.18942 179.4
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