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Ethyl 2-(2-pyridyl-1,2,3,4-tetrahydrobenzo[4,5]thieno[2,3-b]pyridine-1(1H)-yl)acetate
SpectraBase Compound ID 78JJ4LXX7sL
InChI InChI=1S/C20H20N2O2S/c1-2-24-18(23)13-22-12-10-14(16-8-5-6-11-21-16)19-15-7-3-4-9-17(15)25-20(19)22/h3-9,11,14H,2,10,12-13H2,1H3
InChIKey INRTVPFFDBBNKJ-UHFFFAOYSA-N
Mol Weight 352.45 g/mol
Molecular Formula C20H20N2O2S
Exact Mass 352.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxHI1FnsM3h
Name Ethyl 2-(2-pyridyl-1,2,3,4-tetrahydrobenzo[4,5]thieno[2,3-b]pyridine-1(1H)-yl)acetate
Appearance Pale yellow needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O2S
InChI InChI=1S/C20H20N2O2S/c1-2-24-18(23)13-22-12-10-14(16-8-5-6-11-21-16)19-15-7-3-4-9-17(15)25-20(19)22/h3-9,11,14H,2,10,12-13H2,1H3
InChIKey INRTVPFFDBBNKJ-UHFFFAOYSA-N
Instrument Name JEOL JMS 600
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p011.986
Molecular Weight 352.452 g/mol
Quality 105
SMILES C1=2SC3=C(C2C=CC=C1)C(CCN3CC(OCC)=O)C1=CC=CC=N1
SPLASH splash10-000i-0190000000-af20949f9aa696bbd85e
Source of Spectrum ARK-2023-11-9d (DOI: 10.24820/ark.5550190.p011.986)
Wiley ID 1911275