CID 3042990

Brn 1003495

Structural Information

Molecular Formula
C14H12N2OS
SMILES
C1CN2C(=N1)C3=CC=CC=C3C2(C4=CC=CS4)O
InChI
InChI=1S/C14H12N2OS/c17-14(12-6-3-9-18-12)11-5-2-1-4-10(11)13-15-7-8-16(13)14/h1-6,9,17H,7-8H2
InChIKey
QKNPGVNMGIVELF-UHFFFAOYSA-N
Compound name
5-thiophen-2-yl-2,3-dihydroimidazo[1,2-b]isoindol-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

256.06705 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.07433 154.7
[M+Na]+ 279.05627 166.6
[M+NH4]+ 274.10087 166.2
[M+K]+ 295.03021 161.2
[M-H]- 255.05977 157.9
[M+Na-2H]- 277.04172 161.3
[M]+ 256.06650 157.9
[M]- 256.06760 157.9
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