CID 6610273

C2 dihydroceramide

Structural Information

Molecular Formula
C20H41NO3
SMILES
CCCCCCCCCCCCCCC[C@H]([C@H](CO)NC(=O)C)O
InChI
InChI=1S/C20H41NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(24)19(17-22)21-18(2)23/h19-20,22,24H,3-17H2,1-2H3,(H,21,23)/t19-,20+/m0/s1
InChIKey
CRJGESKKUOMBCT-VQTJNVASSA-N
Compound name
N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

174
References

72464
Patents

343.30865 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.31593 193.2
[M+Na]+ 366.29787 197.0
[M+NH4]+ 361.34247 196.5
[M+K]+ 382.27181 191.7
[M-H]- 342.30137 189.8
[M+Na-2H]- 364.28332 190.5
[M]+ 343.30810 192.1
[M]- 343.30920 192.1
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