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1-[2-(1,3-Benzodioxol-5-yl)ethyl]-4a-hydroxy-1,3,4,4a,5,6-hexahydro-2H-cyclopenta[b]pyridin-2-one
SpectraBase Compound ID 5dymUqu2vLO
InChI InChI=1S/C17H19NO4/c19-16-5-8-17(20)7-1-2-15(17)18(16)9-6-12-3-4-13-14(10-12)22-11-21-13/h2-4,10,20H,1,5-9,11H2
InChIKey YDYLEMOBWZLUJJ-UHFFFAOYSA-N
Mol Weight 301.34 g/mol
Molecular Formula C17H19NO4
Exact Mass 301.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nSlg1ZF0wP
Name 1-[2-(1,3-Benzodioxol-5-yl)ethyl]-4a-hydroxy-1,3,4,4a,5,6-hexahydro-2H-cyclopenta[b]pyridin-2-one
CAS Registry Number 114942-66-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO4
InChI InChI=1S/C17H19NO4/c19-16-5-8-17(20)7-1-2-15(17)18(16)9-6-12-3-4-13-14(10-12)22-11-21-13/h2-4,10,20H,1,5-9,11H2
InChIKey YDYLEMOBWZLUJJ-UHFFFAOYSA-N
Molecular Weight 301.342 g/mol
SMILES OC12CCC=C2N(CCc2ccc3c(c2)OCO3)C(CC1)=O
SPLASH splash10-0002-4901000000-2e78713404a7de938dd9
Source of Spectrum J-53-3446-14
Synonyms 1-Homopiperonyl-4a-hydroxy-3,4,5,6-tetrahydro-1-pyrindin-2-one 1-Pyrindin-2-one, 1-[2-(1,3-benzodioxol-5-yl)ethyl]-1,3,4,4a,5,6-hexahydro-4a-hydroxy-, .+/-.- 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4a-hydroxy-3,4,5,6-tetrahydrocyclopenta[b]pyridin-2-one 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4a-oxidanyl-3,4,5,6-tetrahydrocyclopenta[b]pyridin-2-one
Wiley ID 1303871