CID 179357

21249-36-5

Structural Information

Molecular Formula
C34H58N2O2
SMILES
CCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCC1=CNC2=C1C=C(C=C2)O
InChI
InChI=1S/C34H58N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-34(38)35-27-26-30-29-36-33-25-24-31(37)28-32(30)33/h24-25,28-29,36-37H,2-23,26-27H2,1H3,(H,35,38)
InChIKey
QLZQXTNKCAWWES-UHFFFAOYSA-N
Compound name
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]tetracosanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

526.4498 Da
Monoisotopic Mass

12.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 527.45708 244.2
[M+Na]+ 549.43902 242.5
[M-H]- 525.44252 240.8
[M+NH4]+ 544.48362 249.8
[M+K]+ 565.41296 233.3
[M+H-H2O]+ 509.44706 233.5
[M+HCOO]- 571.44800 258.3
[M+CH3COO]- 585.46365 250.5
[M+Na-2H]- 547.42447 237.9
[M]+ 526.44925 251.8
[M]- 526.45035 251.8
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

patents stripe