CID 91649

Hydroxyflutamide

Structural Information

Molecular Formula
C11H11F3N2O4
SMILES
CC(C)(C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F)O
InChI
InChI=1S/C11H11F3N2O4/c1-10(2,18)9(17)15-6-3-4-8(16(19)20)7(5-6)11(12,13)14/h3-5,18H,1-2H3,(H,15,17)
InChIKey
YPQLFJODEKMJEF-UHFFFAOYSA-N
Compound name
2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

328
References

2079
Patents

292.06708 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.074356 154.8
[M+Na]+ 315.056298 161.6
[M-H]- 291.059804 153.8
[M+NH4]+ 310.100903 168.7
[M+K]+ 331.030238 155.3
[M+H-H2O]+ 275.064340 151.6
[M+HCOO]- 337.065281 172.9
[M+CH3COO]- 351.080931 194.3
[M+Na-2H]- 313.041746 161.7
[M]+ 292.06653142 149.1
[M]- 292.06762858 149.1
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