CID 93875

2-decyl-1-tetradecanol

Structural Information

Molecular Formula
C24H50O
SMILES
CCCCCCCCCCCCC(CCCCCCCCCC)CO
InChI
InChI=1S/C24H50O/c1-3-5-7-9-11-13-14-16-18-20-22-24(23-25)21-19-17-15-12-10-8-6-4-2/h24-25H,3-23H2,1-2H3
InChIKey
CAYHVMBQBLYQMT-UHFFFAOYSA-N
Compound name
2-decyltetradecan-1-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

6310
Patents

354.38617 Da
Monoisotopic Mass

11.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.39345 204.6
[M+Na]+ 377.37539 203.6
[M-H]- 353.37889 200.0
[M+NH4]+ 372.41999 217.1
[M+K]+ 393.34933 198.7
[M+H-H2O]+ 337.38343 197.0
[M+HCOO]- 399.38437 220.1
[M+CH3COO]- 413.40002 221.3
[M+Na-2H]- 375.36084 200.2
[M]+ 354.38562 211.5
[M]- 354.38672 211.5
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