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]+ 193.07717 137.8
[M+Na]+ 215.05911 148.3
[M-H]- 191.06261 143.2
[M+NH4]+ 210.10371 156.5
[M+K]+ 231.03305 145.9
[M+H-H2O]+ 175.06715 130.1
[M+HCOO]- 237.06809 161.7
[M+CH3COO]- 251.08374 184.8
[M+Na-2H]- 213.04456 142.9
[M]+ 192.06934 137.3
[M]- 192.07044 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.