CID 3077090

Brn 4251675

Structural Information

Molecular Formula
C11H10N2O2
SMILES
C1C2COC3=CC=CC=C3C2=NNC1=O
InChI
InChI=1S/C11H10N2O2/c14-10-5-7-6-15-9-4-2-1-3-8(9)11(7)13-12-10/h1-4,7H,5-6H2,(H,12,14)
InChIKey
ZYZLFSLGPRNABQ-UHFFFAOYSA-N
Compound name
2,4,4a,5-tetrahydrochromeno[4,3-c]pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.07423 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.08151 140.9
[M+Na]+ 225.06345 149.0
[M-H]- 201.06695 142.5
[M+NH4]+ 220.10805 157.2
[M+K]+ 241.03739 145.8
[M+H-H2O]+ 185.07149 132.9
[M+HCOO]- 247.07243 155.7
[M+CH3COO]- 261.08808 152.5
[M+Na-2H]- 223.04890 150.1
[M]+ 202.07368 137.5
[M]- 202.07478 137.5
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.