CID 138987698

2-bromo-1-methyl-6-{[2-(trimethylsilyl)ethoxy]methyl}-1h,4h,5h,6h,7h-pyrrolo[2,3-c]pyridin-7-one

Structural Information

Molecular Formula
C14H23BrN2O2Si
SMILES
CN1C(=CC2=C1C(=O)N(CC2)COCC[Si](C)(C)C)Br
InChI
InChI=1S/C14H23BrN2O2Si/c1-16-12(15)9-11-5-6-17(14(18)13(11)16)10-19-7-8-20(2,3)4/h9H,5-8,10H2,1-4H3
InChIKey
RDCNKOUUNMHKDL-UHFFFAOYSA-N
Compound name
2-bromo-1-methyl-6-(2-trimethylsilylethoxymethyl)-4,5-dihydropyrrolo[2,3-c]pyridin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.07123 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.07851 179.0
[M+Na]+ 381.06045 190.3
[M-H]- 357.06395 183.3
[M+NH4]+ 376.10505 197.2
[M+K]+ 397.03439 178.8
[M+H-H2O]+ 341.06849 178.3
[M+HCOO]- 403.06943 193.4
[M+CH3COO]- 417.08508 209.8
[M+Na-2H]- 379.04590 181.5
[M]+ 358.07068 200.2
[M]- 358.07178 200.2
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.