CID 18071419

2-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]ethan-1-amine

Structural Information

Molecular Formula
C12H14N2O2
SMILES
COC1=CC=C(C=C1)C2=NC(=CO2)CCN
InChI
InChI=1S/C12H14N2O2/c1-15-11-4-2-9(3-5-11)12-14-10(6-7-13)8-16-12/h2-5,8H,6-7,13H2,1H3
InChIKey
WDZAPDWVDUZWOV-UHFFFAOYSA-N
Compound name
2-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

218.10553 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.11281 147.4
[M+Na]+ 241.09475 155.8
[M-H]- 217.09825 153.4
[M+NH4]+ 236.13935 164.6
[M+K]+ 257.06869 154.0
[M+H-H2O]+ 201.10279 139.8
[M+HCOO]- 263.10373 171.9
[M+CH3COO]- 277.11938 189.1
[M+Na-2H]- 239.08020 152.7
[M]+ 218.10498 149.6
[M]- 218.10608 149.6
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

patents stripe