CID 136503667

N'-(1h-indol-3-ylmethylene)hexadecanohydrazide

Structural Information

Molecular Formula
C25H39N3O
SMILES
CCCCCCCCCCCCCCCC(=O)N/N=C/C1=CNC2=CC=CC=C21
InChI
InChI=1S/C25H39N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-25(29)28-27-21-22-20-26-24-18-16-15-17-23(22)24/h15-18,20-21,26H,2-14,19H2,1H3,(H,28,29)/b27-21+
InChIKey
IYLSLFLLKZBIQF-SZXQPVLSSA-N
Compound name
N-[(E)-1H-indol-3-ylmethylideneamino]hexadecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

397.30933 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 398.31661 204.6
[M+Na]+ 420.29855 206.7
[M-H]- 396.30205 205.6
[M+NH4]+ 415.34315 216.6
[M+K]+ 436.27249 199.8
[M+H-H2O]+ 380.30659 194.6
[M+HCOO]- 442.30753 226.1
[M+CH3COO]- 456.32318 229.8
[M+Na-2H]- 418.28400 205.0
[M]+ 397.30878 209.7
[M]- 397.30988 209.7
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.