CID 11963188

Tetracosane-1,3-diol

Structural Information

Molecular Formula
C24H50O2
SMILES
CCCCCCCCCCCCCCCCCCCCCC(CCO)O
InChI
InChI=1S/C24H50O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)22-23-25/h24-26H,2-23H2,1H3
InChIKey
RWVSXDXGEPXFDB-UHFFFAOYSA-N
Compound name
tetracosane-1,3-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

370.38107 Da
Monoisotopic Mass

10.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.38835 207.5
[M+Na]+ 393.37029 206.0
[M-H]- 369.37379 201.4
[M+NH4]+ 388.41489 218.5
[M+K]+ 409.34423 200.7
[M+H-H2O]+ 353.37833 199.8
[M+HCOO]- 415.37927 221.7
[M+CH3COO]- 429.39492 220.4
[M+Na-2H]- 391.35574 202.6
[M]+ 370.38052 213.9
[M]- 370.38162 213.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe