CID 11005056

Dtxsid401369661

Structural Information

Molecular Formula
C30H39NO3
SMILES
CCCCCCCCCCCCOC1=C(C=C(C=C1)C)NC(=O)C2=C(C3=CC=CC=C3C=C2)O
InChI
InChI=1S/C30H39NO3/c1-3-4-5-6-7-8-9-10-11-14-21-34-28-20-17-23(2)22-27(28)31-30(33)26-19-18-24-15-12-13-16-25(24)29(26)32/h12-13,15-20,22,32H,3-11,14,21H2,1-2H3,(H,31,33)
InChIKey
ZHVBGTCQDFMKLB-UHFFFAOYSA-N
Compound name
N-(2-dodecoxy-5-methylphenyl)-1-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

461.293 Da
Monoisotopic Mass

10.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 462.30028 220.6
[M+Na]+ 484.28222 223.2
[M-H]- 460.28572 224.8
[M+NH4]+ 479.32682 228.9
[M+K]+ 500.25616 216.3
[M+H-H2O]+ 444.29026 209.9
[M+HCOO]- 506.29120 238.1
[M+CH3COO]- 520.30685 239.8
[M+Na-2H]- 482.26767 219.0
[M]+ 461.29245 225.4
[M]- 461.29355 225.4
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.