CID 211584

23417-36-9

Structural Information

Molecular Formula
C11H14N2O
SMILES
CC1=C(C(=CC=C1)NC2=NCCO2)C
InChI
InChI=1S/C11H14N2O/c1-8-4-3-5-10(9(8)2)13-11-12-6-7-14-11/h3-5H,6-7H2,1-2H3,(H,12,13)
InChIKey
CHRXVAHRMWEZBK-UHFFFAOYSA-N
Compound name
N-(2,3-dimethylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

190.11061 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 141.7
[M+Na]+ 213.09983 154.6
[M+NH4]+ 208.14443 150.6
[M+K]+ 229.07377 149.9
[M-H]- 189.10333 147.1
[M+Na-2H]- 211.08528 149.3
[M]+ 190.11006 145.1
[M]- 190.11116 145.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe