CID 28603434

3-(3-fluoro-4-methylphenyl)-1,2-oxazol-5-amine

Structural Information

Molecular Formula
C10H9FN2O
SMILES
CC1=C(C=C(C=C1)C2=NOC(=C2)N)F
InChI
InChI=1S/C10H9FN2O/c1-6-2-3-7(4-8(6)11)9-5-10(12)14-13-9/h2-5H,12H2,1H3
InChIKey
HCITVOJHPPUQKK-UHFFFAOYSA-N
Compound name
3-(3-fluoro-4-methylphenyl)-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.06989 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.077166 137.8
[M+Na]+ 215.059108 148.3
[M-H]- 191.062614 143.2
[M+NH4]+ 210.103713 156.5
[M+K]+ 231.033048 145.9
[M+H-H2O]+ 175.067150 130.1
[M+HCOO]- 237.068091 161.7
[M+CH3COO]- 251.083741 184.8
[M+Na-2H]- 213.044556 142.9
[M]+ 192.06934142 137.3
[M]- 192.07043858 137.3
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.