CID 292901

N-furfurylmaleimide

Structural Information

Molecular Formula
C9H7NO3
SMILES
C1=COC(=C1)CN2C(=O)C=CC2=O
InChI
InChI=1S/C9H7NO3/c11-8-3-4-9(12)10(8)6-7-2-1-5-13-7/h1-5H,6H2
InChIKey
LGSUUIGEQAOVIU-UHFFFAOYSA-N
Compound name
1-(furan-2-ylmethyl)pyrrole-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

177.04259 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.049866 132.7
[M+Na]+ 200.031808 142.5
[M-H]- 176.035314 139.5
[M+NH4]+ 195.076413 153.7
[M+K]+ 216.005748 141.9
[M+H-H2O]+ 160.039850 127.0
[M+HCOO]- 222.040791 157.6
[M+CH3COO]- 236.056441 176.9
[M+Na-2H]- 198.017256 136.9
[M]+ 177.04204142 135.0
[M]- 177.04313858 135.0
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

patents stripe