CID 135686405

59986-55-9

Structural Information

Molecular Formula
C22H28ClNO2
SMILES
CCCCCCCCCC1=CC(=C(C(=C1)Cl)O)/C(=N\O)/C2=CC=CC=C2
InChI
InChI=1S/C22H28ClNO2/c1-2-3-4-5-6-7-9-12-17-15-19(22(25)20(23)16-17)21(24-26)18-13-10-8-11-14-18/h8,10-11,13-16,25-26H,2-7,9,12H2,1H3/b24-21-
InChIKey
FGTCYTZEIKWZRE-FLFQWRMESA-N
Compound name
2-chloro-6-[(Z)-N-hydroxy-C-phenylcarbonimidoyl]-4-nonylphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

33
Patents

373.18085 Da
Monoisotopic Mass

8.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.188126 192.7
[M+Na]+ 396.170068 198.0
[M-H]- 372.173574 197.1
[M+NH4]+ 391.214673 205.0
[M+K]+ 412.144008 190.7
[M+H-H2O]+ 356.178110 184.8
[M+HCOO]- 418.179051 209.0
[M+CH3COO]- 432.194701 218.8
[M+Na-2H]- 394.155516 192.5
[M]+ 373.18030142 196.9
[M]- 373.18139858 196.9
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.