CID 218363

O-toluidine, 4-methoxy-n-(2-oxazolin-2-yl)-

Structural Information

Molecular Formula
C11H14N2O2
SMILES
CC1=C(C=CC(=C1)OC)NC2=NCCO2
InChI
InChI=1S/C11H14N2O2/c1-8-7-9(14-2)3-4-10(8)13-11-12-5-6-15-11/h3-4,7H,5-6H2,1-2H3,(H,12,13)
InChIKey
KVIBUICYBXTYJO-UHFFFAOYSA-N
Compound name
N-(4-methoxy-2-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.10553 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.112806 144.0
[M+Na]+ 229.094748 151.9
[M-H]- 205.098254 150.4
[M+NH4]+ 224.139353 162.0
[M+K]+ 245.068688 150.9
[M+H-H2O]+ 189.102790 136.6
[M+HCOO]- 251.103731 168.1
[M+CH3COO]- 265.119381 186.4
[M+Na-2H]- 227.080196 150.0
[M]+ 206.10498142 145.4
[M]- 206.10607858 145.4
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

No patent data available for this compound.