CID 134744193

Cer(d14:0/14:0)

Structural Information

Molecular Formula
C28H57NO3
SMILES
CCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@@H](CCCCCCCCCCC)O
InChI
InChI=1S/C28H57NO3/c1-3-5-7-9-11-13-14-16-18-20-22-24-28(32)29-26(25-30)27(31)23-21-19-17-15-12-10-8-6-4-2/h26-27,30-31H,3-25H2,1-2H3,(H,29,32)/t26-,27+/m0/s1
InChIKey
KLBQTAJWYPPMOQ-RRPNLBNLSA-N
Compound name
N-[(2S,3R)-1,3-dihydroxytetradecan-2-yl]tetradecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

455.43384 Da
Monoisotopic Mass

10.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 456.44112 230.6
[M+Na]+ 478.42306 241.2
[M-H]- 454.42656 223.5
[M+NH4]+ 473.46766 232.0
[M+K]+ 494.39700 221.3
[M+H-H2O]+ 438.43110 221.9
[M+HCOO]- 500.43204 235.0
[M+CH3COO]- 514.44769 239.0
[M+Na-2H]- 476.40851 221.7
[M]+ 455.43329 231.1
[M]- 455.43439 231.1
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.