CID 121800

29246-97-7

Structural Information

Molecular Formula
C29H37NO2
SMILES
CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O
InChI
InChI=1S/C29H37NO2/c1-2-3-4-5-6-7-8-9-10-11-14-23-17-19-26(20-18-23)30-29(32)27-21-24-15-12-13-16-25(24)22-28(27)31/h12-13,15-22,31H,2-11,14H2,1H3,(H,30,32)
InChIKey
RSEDMFBYNDMBTA-UHFFFAOYSA-N
Compound name
N-(4-dodecylphenyl)-3-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

431.28244 Da
Monoisotopic Mass

10.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 432.28972 212.7
[M+Na]+ 454.27166 215.1
[M-H]- 430.27516 216.8
[M+NH4]+ 449.31626 222.1
[M+K]+ 470.24560 207.6
[M+H-H2O]+ 414.27970 202.3
[M+HCOO]- 476.28064 230.5
[M+CH3COO]- 490.29629 233.6
[M+Na-2H]- 452.25711 212.3
[M]+ 431.28189 215.4
[M]- 431.28299 215.4
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.