CID 6434142

2-[(1z)-2-nitroprop-1-en-1-yl]furan

Structural Information

Molecular Formula
C7H7NO3
SMILES
C/C(=C/C1=CC=CO1)/[N+](=O)[O-]
InChI
InChI=1S/C7H7NO3/c1-6(8(9)10)5-7-3-2-4-11-7/h2-5H,1H3/b6-5-
InChIKey
ZJQJRPWHHXBVQO-WAYWQWQTSA-N
Compound name
2-[(Z)-2-nitroprop-1-enyl]furan
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

153.04259 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.04987 129.3
[M+Na]+ 176.03181 140.8
[M+NH4]+ 171.07641 137.3
[M+K]+ 192.00575 140.5
[M-H]- 152.03531 132.6
[M+Na-2H]- 174.01726 134.0
[M]+ 153.04204 131.6
[M]- 153.04314 131.6
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

No patent data available for this compound.