CID 37819226

7-iodopyrido[2,3-b]pyrazine

Structural Information

Molecular Formula
C7H4IN3
SMILES
C1=CN=C2C(=N1)C=C(C=N2)I
InChI
InChI=1S/C7H4IN3/c8-5-3-6-7(11-4-5)10-2-1-9-6/h1-4H
InChIKey
FYCNIEVXOCZGKK-UHFFFAOYSA-N
Compound name
7-iodopyrido[2,3-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.94498 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.95226 127.5
[M+Na]+ 279.93420 130.9
[M-H]- 255.93770 121.2
[M+NH4]+ 274.97880 141.0
[M+K]+ 295.90814 133.7
[M+H-H2O]+ 239.94224 116.2
[M+HCOO]- 301.94318 143.6
[M+CH3COO]- 315.95883 137.1
[M+Na-2H]- 277.91965 127.7
[M]+ 256.94443 125.0
[M]- 256.94553 125.0
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

No patent data available for this compound.