CID 85780367

2-tetracosanone

Structural Information

Molecular Formula
C24H48O
SMILES
CCCCCCCCCCCCCCCCCCCCCCC(=O)C
InChI
InChI=1S/C24H48O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(2)25/h3-23H2,1-2H3
InChIKey
YLXYBDHLRCMBAL-UHFFFAOYSA-N
Compound name
tetracosan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

246
Patents

352.3705 Da
Monoisotopic Mass

11.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.37778 202.6
[M+Na]+ 375.35972 202.5
[M-H]- 351.36322 199.6
[M+NH4]+ 370.40432 215.9
[M+K]+ 391.33366 197.8
[M+H-H2O]+ 335.36776 194.9
[M+HCOO]- 397.36870 219.9
[M+CH3COO]- 411.38435 223.1
[M+Na-2H]- 373.34517 198.8
[M]+ 352.36995 210.9
[M]- 352.37105 210.9
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.