CID 5846291

303095-05-8

Structural Information

Molecular Formula
C9H10N2O3
SMILES
CN(C)/N=C(/C=O)\C1=CC=C(O1)C=O
InChI
InChI=1S/C9H10N2O3/c1-11(2)10-8(6-13)9-4-3-7(5-12)14-9/h3-6H,1-2H3/b10-8-
InChIKey
CPBDLQLRQNZDNG-NTMALXAHSA-N
Compound name
5-[(E)-N-(dimethylamino)-C-formylcarbonimidoyl]furan-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.06914 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.07642 140.7
[M+Na]+ 217.05836 148.3
[M-H]- 193.06186 148.1
[M+NH4]+ 212.10296 161.3
[M+K]+ 233.03230 149.8
[M+H-H2O]+ 177.06640 134.2
[M+HCOO]- 239.06734 169.3
[M+CH3COO]- 253.08299 192.1
[M+Na-2H]- 215.04381 146.1
[M]+ 194.06859 145.3
[M]- 194.06969 145.3
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.