CID 5002364

16780-94-2

Structural Information

Molecular Formula
C10H8N2O
SMILES
C1CN2C(=N1)C3=CC=CC=C3C2=O
InChI
InChI=1S/C10H8N2O/c13-10-8-4-2-1-3-7(8)9-11-5-6-12(9)10/h1-4H,5-6H2
InChIKey
KBYGABSMKUYDEM-UHFFFAOYSA-N
Compound name
2,3-dihydroimidazo[1,2-b]isoindol-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

172.06366 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.070936 134.4
[M+Na]+ 195.052878 145.2
[M-H]- 171.056384 137.9
[M+NH4]+ 190.097483 157.9
[M+K]+ 211.026818 141.9
[M+H-H2O]+ 155.060920 128.0
[M+HCOO]- 217.061861 156.3
[M+CH3COO]- 231.077511 148.7
[M+Na-2H]- 193.038326 140.1
[M]+ 172.06311142 135.0
[M]- 172.06420858 135.0
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

patents stripe