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11-(propionylthio)-5,8,9,10-tetrahydro-6H-1,3-dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepine
SpectraBase Compound ID C9LZELJkpdh
InChI InChI=1S/C17H19NO3S/c1-2-16(19)22-17-12-9-15-14(20-10-21-15)8-11(12)5-7-18-6-3-4-13(17)18/h8-9H,2-7,10H2,1H3
InChIKey GSFNOLWJKKMIIF-UHFFFAOYSA-N
Mol Weight 317.4 g/mol
Molecular Formula C17H19NO3S
Exact Mass 317.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HDcajHfDBwg
Name 11-(propionylthio)-5,8,9,10-tetrahydro-6H-1,3-dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepine
CAS Registry Number 124021-98-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO3S
InChI InChI=1S/C17H19NO3S/c1-2-16(19)22-17-12-9-15-14(20-10-21-15)8-11(12)5-7-18-6-3-4-13(17)18/h8-9H,2-7,10H2,1H3
InChIKey GSFNOLWJKKMIIF-UHFFFAOYSA-N
Molecular Weight 317.403 g/mol
SMILES C1(=C2N(CCc3c1cc1c(OCO1)c3)CCC2)SC(=O)CC
SPLASH splash10-0400-0091000000-831f4cc76dba01d22a06
Source of Spectrum J-55-837-42
Synonyms S-(5,8,9,10-tetrahydro-6H-[1,3]dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepin-11-yl) propanethioate
Wiley ID 1317646