CID 10729993

Imoproxifan

Structural Information

Molecular Formula
C14H17N3O2
SMILES
C/C(=N\O)/C1=CC=C(C=C1)OCCCC2=CN=CN2
InChI
InChI=1S/C14H17N3O2/c1-11(17-18)12-4-6-14(7-5-12)19-8-2-3-13-9-15-10-16-13/h4-7,9-10,18H,2-3,8H2,1H3,(H,15,16)/b17-11+
InChIKey
GHADIQOLHLUYIM-GZTJUZNOSA-N
Compound name
(NE)-N-[1-[4-[3-(1H-imidazol-5-yl)propoxy]phenyl]ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

18
Patents

259.13208 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.13936 160.9
[M+Na]+ 282.12130 171.6
[M+NH4]+ 277.16590 167.1
[M+K]+ 298.09524 167.4
[M-H]- 258.12480 162.6
[M+Na-2H]- 280.10675 167.3
[M]+ 259.13153 162.6
[M]- 259.13263 162.6
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