CID 130907297

2-cyclopropyl-5-iodo-4-methylpyrimidine

Structural Information

Molecular Formula
C8H9IN2
SMILES
CC1=NC(=NC=C1I)C2CC2
InChI
InChI=1S/C8H9IN2/c1-5-7(9)4-10-8(11-5)6-2-3-6/h4,6H,2-3H2,1H3
InChIKey
FRMHDGDJRLRBPA-UHFFFAOYSA-N
Compound name
2-cyclopropyl-5-iodo-4-methylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.98105 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.98833 139.1
[M+Na]+ 282.97027 147.2
[M+NH4]+ 278.01487 144.4
[M+K]+ 298.94421 145.0
[M-H]- 258.97377 142.5
[M+Na-2H]- 280.95572 137.9
[M]+ 259.98050 141.3
[M]- 259.98160 141.3
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.