CID 3046783

N,n-dibutyl-4-(((5-fluoro-2-hydroxyphenyl)phenylmethylene)amino)butanamide

Structural Information

Molecular Formula
C25H33FN2O2
SMILES
CCCCN(CCCC)C(=O)CCCN=C(C1=CC=CC=C1)C2=C(C=CC(=C2)F)O
InChI
InChI=1S/C25H33FN2O2/c1-3-5-17-28(18-6-4-2)24(30)13-10-16-27-25(20-11-8-7-9-12-20)22-19-21(26)14-15-23(22)29/h7-9,11-12,14-15,19,29H,3-6,10,13,16-18H2,1-2H3
InChIKey
XPWCVJWCRINGJP-UHFFFAOYSA-N
Compound name
N,N-dibutyl-4-[[(5-fluoro-2-hydroxyphenyl)-phenylmethylidene]amino]butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

412.2526 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.25988 206.1
[M+Na]+ 435.24182 215.5
[M+NH4]+ 430.28642 211.2
[M+K]+ 451.21576 207.4
[M-H]- 411.24532 209.1
[M+Na-2H]- 433.22727 211.3
[M]+ 412.25205 208.0
[M]- 412.25315 208.0
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.