CID 4361134

3-(4-methoxyphenyl)isoxazol-5-amine

Structural Information

Molecular Formula
C10H10N2O2
SMILES
COC1=CC=C(C=C1)C2=NOC(=C2)N
InChI
InChI=1S/C10H10N2O2/c1-13-8-4-2-7(3-5-8)9-6-10(11)14-12-9/h2-6H,11H2,1H3
InChIKey
PHOQFLXRNUDPHQ-UHFFFAOYSA-N
Compound name
3-(4-methoxyphenyl)-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

27
Patents

190.07423 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.08151 139.0
[M+Na]+ 213.06345 152.1
[M+NH4]+ 208.10805 147.2
[M+K]+ 229.03739 148.3
[M-H]- 189.06695 143.9
[M+Na-2H]- 211.04890 146.7
[M]+ 190.07368 142.2
[M]- 190.07478 142.2
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