CID 165942542

1,3-dibromo-5h,6h,7h-pyrrolo[1,2-c]imidazole

Structural Information

Molecular Formula
C6H6Br2N2
SMILES
C1CC2=C(N=C(N2C1)Br)Br
InChI
InChI=1S/C6H6Br2N2/c7-5-4-2-1-3-10(4)6(8)9-5/h1-3H2
InChIKey
CUNLVLDOPSMILB-UHFFFAOYSA-N
Compound name
1,3-dibromo-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.88977 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.89705 137.8
[M+Na]+ 286.87899 151.1
[M-H]- 262.88249 144.1
[M+NH4]+ 281.92359 160.2
[M+K]+ 302.85293 137.2
[M+H-H2O]+ 246.88703 146.5
[M+HCOO]- 308.88797 153.9
[M+CH3COO]- 322.90362 153.0
[M+Na-2H]- 284.86444 144.2
[M]+ 263.88922 171.4
[M]- 263.89032 171.4
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.