CID 3076171

Brn 5818121

Structural Information

Molecular Formula
C14H18N2O2
SMILES
CC1C(ON=C1C(=O)NC2=C(C=CC=C2C)C)C
InChI
InChI=1S/C14H18N2O2/c1-8-6-5-7-9(2)12(8)15-14(17)13-10(3)11(4)18-16-13/h5-7,10-11H,1-4H3,(H,15,17)
InChIKey
QRFYGTRSBAYBIW-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-4,5-dimethyl-4,5-dihydro-1,2-oxazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.13683 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.14411 157.7
[M+Na]+ 269.12605 169.9
[M+NH4]+ 264.17065 165.0
[M+K]+ 285.09999 166.2
[M-H]- 245.12955 162.2
[M+Na-2H]- 267.11150 163.0
[M]+ 246.13628 160.6
[M]- 246.13738 160.6
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

No patent data available for this compound.