CID 3071655

Cyclohexanecarboxamide, n-(2-(7-methoxy-1-naphthalenyl)ethyl)-

Structural Information

Molecular Formula
C20H25NO2
SMILES
COC1=CC2=C(C=CC=C2CCNC(=O)C3CCCCC3)C=C1
InChI
InChI=1S/C20H25NO2/c1-23-18-11-10-15-8-5-9-16(19(15)14-18)12-13-21-20(22)17-6-3-2-4-7-17/h5,8-11,14,17H,2-4,6-7,12-13H2,1H3,(H,21,22)
InChIKey
FYENMWPCFFHHCA-UHFFFAOYSA-N
Compound name
N-[2-(7-methoxynaphthalen-1-yl)ethyl]cyclohexanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3
Patents

311.18854 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.19582 174.7
[M+Na]+ 334.17776 177.8
[M-H]- 310.18126 180.6
[M+NH4]+ 329.22236 189.5
[M+K]+ 350.15170 173.4
[M+H-H2O]+ 294.18580 165.9
[M+HCOO]- 356.18674 193.0
[M+CH3COO]- 370.20239 209.4
[M+Na-2H]- 332.16321 177.5
[M]+ 311.18799 171.7
[M]- 311.18909 171.7
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