CID 106751

67642-21-1

Structural Information

Molecular Formula
C15H23N3O5
SMILES
CC1CCCC(N1CC(CON=CC2=CC=C(O2)[N+](=O)[O-])O)C
InChI
InChI=1S/C15H23N3O5/c1-11-4-3-5-12(2)17(11)9-13(19)10-22-16-8-14-6-7-15(23-14)18(20)21/h6-8,11-13,19H,3-5,9-10H2,1-2H3
InChIKey
ZWYRRICTZOUHEE-UHFFFAOYSA-N
Compound name
1-(2,6-dimethylpiperidin-1-yl)-3-[(5-nitrofuran-2-yl)methylideneamino]oxypropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.16376 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.17104 175.1
[M+Na]+ 348.15298 183.6
[M+NH4]+ 343.19758 180.1
[M+K]+ 364.12692 184.1
[M-H]- 324.15648 178.8
[M+Na-2H]- 346.13843 177.0
[M]+ 325.16321 176.8
[M]- 325.16431 176.8
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.