CID 30691

21561-23-9

Structural Information

Molecular Formula
C11H14N2O3
SMILES
COC1=C(C(=CC=C1)OC)NC2=NCCO2
InChI
InChI=1S/C11H14N2O3/c1-14-8-4-3-5-9(15-2)10(8)13-11-12-6-7-16-11/h3-5H,6-7H2,1-2H3,(H,12,13)
InChIKey
OMTQSCUQXFQWLU-UHFFFAOYSA-N
Compound name
N-(2,6-dimethoxyphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.10045 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.10773 146.7
[M+Na]+ 245.08967 154.4
[M-H]- 221.09317 153.1
[M+NH4]+ 240.13427 164.0
[M+K]+ 261.06361 154.0
[M+H-H2O]+ 205.09771 139.1
[M+HCOO]- 267.09865 171.0
[M+CH3COO]- 281.11430 188.5
[M+Na-2H]- 243.07512 152.8
[M]+ 222.09990 149.5
[M]- 222.10100 149.5
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.