CID 18462343

61747-22-6

Structural Information

Molecular Formula
C13H16F3NO2
SMILES
COCCCC/C(=N/O)/C1=CC=C(C=C1)C(F)(F)F
InChI
InChI=1S/C13H16F3NO2/c1-19-9-3-2-4-12(17-18)10-5-7-11(8-6-10)13(14,15)16/h5-8,18H,2-4,9H2,1H3/b17-12-
InChIKey
UDCRPPVSQRFBKJ-ATVHPVEESA-N
Compound name
(NZ)-N-[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

16
Patents

275.1133 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.12058 164.2
[M+Na]+ 298.10252 171.4
[M+NH4]+ 293.14712 168.5
[M+K]+ 314.07646 166.3
[M-H]- 274.10602 160.8
[M+Na-2H]- 296.08797 167.0
[M]+ 275.11275 163.8
[M]- 275.11385 163.8
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