CID 1617338

2-(trifluoromethyl)benzaldehyde oxime

Structural Information

Molecular Formula
C8H6F3NO
SMILES
C1=CC=C(C(=C1)C=NO)C(F)(F)F
InChI
InChI=1S/C8H6F3NO/c9-8(10,11)7-4-2-1-3-6(7)5-12-13/h1-5,13H
InChIKey
GBZLIAANNYDSOB-UHFFFAOYSA-N
Compound name
N-[[2-(trifluoromethyl)phenyl]methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

105
Patents

189.04015 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.04743 140.3
[M+Na]+ 212.02937 149.2
[M+NH4]+ 207.07397 146.0
[M+K]+ 228.00331 143.9
[M-H]- 188.03287 137.7
[M+Na-2H]- 210.01482 145.1
[M]+ 189.03960 140.5
[M]- 189.04070 140.5
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

patents stripe