CID 39870023

2-[(furan-2-yl)methoxy]-5-nitropyridine

Structural Information

Molecular Formula
C10H8N2O4
SMILES
C1=COC(=C1)COC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C10H8N2O4/c13-12(14)8-3-4-10(11-6-8)16-7-9-2-1-5-15-9/h1-6H,7H2
InChIKey
DQTSFYSTYVVZHJ-UHFFFAOYSA-N
Compound name
2-(furan-2-ylmethoxy)-5-nitropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.0484 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.05568 143.7
[M+Na]+ 243.03762 151.1
[M-H]- 219.04112 150.3
[M+NH4]+ 238.08222 160.0
[M+K]+ 259.01156 146.5
[M+H-H2O]+ 203.04566 140.7
[M+HCOO]- 265.04660 169.5
[M+CH3COO]- 279.06225 179.4
[M+Na-2H]- 241.02307 153.0
[M]+ 220.04785 145.1
[M]- 220.04895 145.1
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.