CID 5370221

Retinamide

Structural Information

Molecular Formula
C20H29NO
SMILES
CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)N)/C)/C
InChI
InChI=1S/C20H29NO/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H2,21,22)/b9-6+,12-11+,15-8+,16-14+
InChIKey
NUXWXMZVAHSICO-YCNIQYBTSA-N
Compound name
(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

44
References

7169
Patents

299.2249 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.23218 179.2
[M+Na]+ 322.21412 187.1
[M+NH4]+ 317.25872 186.0
[M+K]+ 338.18806 178.7
[M-H]- 298.21762 179.5
[M+Na-2H]- 320.19957 181.6
[M]+ 299.22435 180.1
[M]- 299.22545 180.1
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