CID 132547348

Am-1488

Structural Information

Molecular Formula
C19H17N3O4S
SMILES
CN1C2=C(C=NC=C2)[C@H]3CN(C[C@H]3C1=O)S(=O)(=O)C4=CC5=C(C=C4)OC=C5
InChI
InChI=1S/C19H17N3O4S/c1-21-17-4-6-20-9-14(17)15-10-22(11-16(15)19(21)23)27(24,25)13-2-3-18-12(8-13)5-7-26-18/h2-9,15-16H,10-11H2,1H3/t15-,16-/m1/s1
InChIKey
QODWZTUPLVMSQR-HZPDHXFCSA-N
Compound name
(3aS,9bS)-2-(1-benzofuran-5-ylsulfonyl)-5-methyl-1,3,3a,9b-tetrahydropyrrolo[3,4-c][1,6]naphthyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

383.09396 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 384.10124 186.3
[M+Na]+ 406.08318 200.2
[M+NH4]+ 401.12778 193.6
[M+K]+ 422.05712 196.0
[M-H]- 382.08668 189.8
[M+Na-2H]- 404.06863 189.8
[M]+ 383.09341 189.8
[M]- 383.09451 189.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.