CID 14698709

57666-46-3

Structural Information

Molecular Formula
C12H8F3NO2
SMILES
C1=CC(=CC(=C1)C(F)(F)F)C2=CC=C(O2)/C=N/O
InChI
InChI=1S/C12H8F3NO2/c13-12(14,15)9-3-1-2-8(6-9)11-5-4-10(18-11)7-16-17/h1-7,17H/b16-7+
InChIKey
MAOLWMOVMYZMQJ-FRKPEAEDSA-N
Compound name
(NE)-N-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.05072 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.05800 158.6
[M+Na]+ 278.03994 167.9
[M+NH4]+ 273.08454 163.9
[M+K]+ 294.01388 164.2
[M-H]- 254.04344 158.4
[M+Na-2H]- 276.02539 163.3
[M]+ 255.05017 159.6
[M]- 255.05127 159.6
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

No patent data available for this compound.