CID 58977

Nonanamide, n-(2-furfuryl)-

Structural Information

Molecular Formula
C14H23NO2
SMILES
CCCCCCCCC(=O)NCC1=CC=CO1
InChI
InChI=1S/C14H23NO2/c1-2-3-4-5-6-7-10-14(16)15-12-13-9-8-11-17-13/h8-9,11H,2-7,10,12H2,1H3,(H,15,16)
InChIKey
GEOLNLWCLNDIFB-UHFFFAOYSA-N
Compound name
N-(furan-2-ylmethyl)nonanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.17288 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.180156 160.4
[M+Na]+ 260.162098 164.7
[M-H]- 236.165604 163.5
[M+NH4]+ 255.206703 178.2
[M+K]+ 276.136038 163.4
[M+H-H2O]+ 220.170140 153.5
[M+HCOO]- 282.171081 183.7
[M+CH3COO]- 296.186731 194.6
[M+Na-2H]- 258.147546 163.5
[M]+ 237.17233142 164.1
[M]- 237.17342858 164.1
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.