CID 9632931

N-(2-oxo-2-(2-(3-phenoxybenzylidene)hydrazino)ethyl)tetradecanamide

Structural Information

Molecular Formula
C29H41N3O3
SMILES
CCCCCCCCCCCCCC(=O)NCC(=O)N/N=C/C1=CC(=CC=C1)OC2=CC=CC=C2
InChI
InChI=1S/C29H41N3O3/c1-2-3-4-5-6-7-8-9-10-11-15-21-28(33)30-24-29(34)32-31-23-25-17-16-20-27(22-25)35-26-18-13-12-14-19-26/h12-14,16-20,22-23H,2-11,15,21,24H2,1H3,(H,30,33)(H,32,34)/b31-23+
InChIKey
SKROOXZYWYCHCN-UQRQXUALSA-N
Compound name
N-[2-oxo-2-[(2E)-2-[(3-phenoxyphenyl)methylidene]hydrazinyl]ethyl]tetradecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

479.3148 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 480.32208 224.2
[M+Na]+ 502.30402 222.9
[M-H]- 478.30752 229.1
[M+NH4]+ 497.34862 230.7
[M+K]+ 518.27796 217.7
[M+H-H2O]+ 462.31206 212.2
[M+HCOO]- 524.31300 247.0
[M+CH3COO]- 538.32865 248.6
[M+Na-2H]- 500.28947 223.1
[M]+ 479.31425 229.0
[M]- 479.31535 229.0
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.