CID 66902

N-(4-hydroxyphenyl)dodecanamide

Structural Information

Molecular Formula
C18H29NO2
SMILES
CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)O
InChI
InChI=1S/C18H29NO2/c1-2-3-4-5-6-7-8-9-10-11-18(21)19-16-12-14-17(20)15-13-16/h12-15,20H,2-11H2,1H3,(H,19,21)
InChIKey
JVKWTDRHWOSRFT-UHFFFAOYSA-N
Compound name
N-(4-hydroxyphenyl)dodecanamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

6
References

6075
Patents

291.21982 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.227096 175.1
[M+Na]+ 314.209038 178.2
[M-H]- 290.212544 175.9
[M+NH4]+ 309.253643 189.7
[M+K]+ 330.182978 174.1
[M+H-H2O]+ 274.217080 167.5
[M+HCOO]- 336.218021 195.8
[M+CH3COO]- 350.233671 205.2
[M+Na-2H]- 312.194486 176.2
[M]+ 291.21927142 177.4
[M]- 291.22036858 177.4
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