CID 31291

Tetradecanal

Structural Information

Molecular Formula
C14H28O
SMILES
CCCCCCCCCCCCCC=O
InChI
InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h14H,2-13H2,1H3
InChIKey
UHUFTBALEZWWIH-UHFFFAOYSA-N
Compound name
tetradecanal
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

355
References

19997
Patents

212.21402 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.22130 155.7
[M+Na]+ 235.20324 165.3
[M+NH4]+ 230.24784 163.0
[M+K]+ 251.17718 156.8
[M-H]- 211.20674 155.4
[M+Na-2H]- 233.18869 158.3
[M]+ 212.21347 156.8
[M]- 212.21457 156.8
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