CID 43359

Furmecyclox

Structural Information

Molecular Formula
C14H21NO3
SMILES
CC1=CC(=C(O1)C)C(=O)N(C2CCCCC2)OC
InChI
InChI=1S/C14H21NO3/c1-10-9-13(11(2)18-10)14(16)15(17-3)12-7-5-4-6-8-12/h9,12H,4-8H2,1-3H3
InChIKey
QTDRLOKFLJJHTG-UHFFFAOYSA-N
Compound name
N-cyclohexyl-N-methoxy-2,5-dimethylfuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

11357
Patents

251.15215 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.15943 159.2
[M+Na]+ 274.14137 163.8
[M-H]- 250.14487 167.4
[M+NH4]+ 269.18597 177.0
[M+K]+ 290.11531 164.4
[M+H-H2O]+ 234.14941 152.4
[M+HCOO]- 296.15035 180.5
[M+CH3COO]- 310.16600 199.1
[M+Na-2H]- 272.12682 159.9
[M]+ 251.15160 159.6
[M]- 251.15270 159.6
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