CID 135821940

N'-(5-bromo-2-hydroxybenzylidene)tetradecanohydrazide

Structural Information

Molecular Formula
C21H33BrN2O2
SMILES
CCCCCCCCCCCCCC(=O)N/N=C/C1=C(C=CC(=C1)Br)O
InChI
InChI=1S/C21H33BrN2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-21(26)24-23-17-18-16-19(22)14-15-20(18)25/h14-17,25H,2-13H2,1H3,(H,24,26)/b23-17+
InChIKey
MIPIXRGXOFOMCX-HAVVHWLPSA-N
Compound name
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]tetradecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

424.17255 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.17983 199.1
[M+Na]+ 447.16177 204.5
[M-H]- 423.16527 203.1
[M+NH4]+ 442.20637 212.5
[M+K]+ 463.13571 190.4
[M+H-H2O]+ 407.16981 195.1
[M+HCOO]- 469.17075 218.5
[M+CH3COO]- 483.18640 228.7
[M+Na-2H]- 445.14722 199.6
[M]+ 424.17200 221.0
[M]- 424.17310 221.0
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.