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]+ 420.285676 206.6
[M+Na]+ 442.267618 206.7
[M-H]- 418.271124 206.7
[M+NH4]+ 437.312223 215.0
[M+K]+ 458.241558 202.5
[M+H-H2O]+ 402.275660 197.0
[M+HCOO]- 464.276601 227.3
[M+CH3COO]- 478.292251 234.1
[M+Na-2H]- 440.253066 204.3
[M]+ 419.27785142 210.1
[M]- 419.27894858 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.