CID 83680576

4-bromo-3-methoxy-6-methylpyridazine

Structural Information

Molecular Formula
C6H7BrN2O
SMILES
CC1=CC(=C(N=N1)OC)Br
InChI
InChI=1S/C6H7BrN2O/c1-4-3-5(7)6(10-2)9-8-4/h3H,1-2H3
InChIKey
AZCGDVMYWBSFOK-UHFFFAOYSA-N
Compound name
4-bromo-3-methoxy-6-methylpyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.97418 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.981456 129.3
[M+Na]+ 224.963398 142.9
[M-H]- 200.966904 133.7
[M+NH4]+ 220.008003 150.1
[M+K]+ 240.937338 133.0
[M+H-H2O]+ 184.971440 128.9
[M+HCOO]- 246.972381 150.1
[M+CH3COO]- 260.988031 182.5
[M+Na-2H]- 222.948846 139.0
[M]+ 201.97363142 149.9
[M]- 201.97472858 149.9
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.