CID 136499976

765311-96-4

Structural Information

Molecular Formula
C23H37N3O4
SMILES
CCCCCCCCCCCCCC(=O)NCC(=O)N/N=C/C1=C(C=C(C=C1)O)O
InChI
InChI=1S/C23H37N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-22(29)24-18-23(30)26-25-17-19-14-15-20(27)16-21(19)28/h14-17,27-28H,2-13,18H2,1H3,(H,24,29)(H,26,30)/b25-17+
InChIKey
XEHQYEAPKCTVEP-KOEQRZSOSA-N
Compound name
N-[2-[(2E)-2-[(2,4-dihydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

419.2784 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 420.28568 206.6
[M+Na]+ 442.26762 206.7
[M-H]- 418.27112 206.7
[M+NH4]+ 437.31222 215.0
[M+K]+ 458.24156 202.5
[M+H-H2O]+ 402.27566 197.0
[M+HCOO]- 464.27660 227.3
[M+CH3COO]- 478.29225 234.1
[M+Na-2H]- 440.25307 204.3
[M]+ 419.27785 210.1
[M]- 419.27895 210.1
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.