CID 9588200

Brn 1449012

Structural Information

Molecular Formula
C7H6N2O2
SMILES
C1=CC(=CN=C1)/C=N/OC=O
InChI
InChI=1S/C7H6N2O2/c10-6-11-9-5-7-2-1-3-8-4-7/h1-6H/b9-5+
InChIKey
HEVGJHJMZOBCIB-WEVVVXLNSA-N
Compound name
[(E)-pyridin-3-ylmethylideneamino] formate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.04292 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.05020 128.4
[M+Na]+ 173.03214 140.9
[M+NH4]+ 168.07674 136.2
[M+K]+ 189.00608 134.5
[M-H]- 149.03564 130.2
[M+Na-2H]- 171.01759 136.4
[M]+ 150.04237 130.4
[M]- 150.04347 130.4
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.