CID 101989361

6-bromopyrrolo[1,2-c]pyrimidine

Structural Information

Molecular Formula
C7H5BrN2
SMILES
C1=CN=CN2C1=CC(=C2)Br
InChI
InChI=1S/C7H5BrN2/c8-6-3-7-1-2-9-5-10(7)4-6/h1-5H
InChIKey
RDFCRFWSRIKZRZ-UHFFFAOYSA-N
Compound name
6-bromopyrrolo[1,2-c]pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.96361 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.97089 133.7
[M+Na]+ 218.95283 138.9
[M+NH4]+ 213.99743 139.6
[M+K]+ 234.92677 139.4
[M-H]- 194.95633 134.2
[M+Na-2H]- 216.93828 138.5
[M]+ 195.96306 133.5
[M]- 195.96416 133.5
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.