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3,3-Dimethyl-9-methylthio-6-phenyl-10,11-dihydropyrrolo[a][1,3]-dioxazino[4,5-e][4,1]oxazocin-1(6H)-one
SpectraBase Compound ID 8wpiBMsctDm
InChI InChI=1S/C20H21NO4S/c1-20(2)24-18(22)14-11-12-21-15(9-10-16(21)26-3)17(23-19(14)25-20)13-7-5-4-6-8-13/h4-10,17H,11-12H2,1-3H3
InChIKey VPAXNGIBGFIJJV-UHFFFAOYSA-N
Mol Weight 371.45 g/mol
Molecular Formula C20H21NO4S
Exact Mass 371.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFv2UscYUuB
Name 3,3-Dimethyl-9-methylthio-6-phenyl-10,11-dihydropyrrolo[a][1,3]-dioxazino[4,5-e][4,1]oxazocin-1(6H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO4S
InChI InChI=1S/C20H21NO4S/c1-20(2)24-18(22)14-11-12-21-15(9-10-16(21)26-3)17(23-19(14)25-20)13-7-5-4-6-8-13/h4-10,17H,11-12H2,1-3H3
InChIKey VPAXNGIBGFIJJV-UHFFFAOYSA-N
Molecular Weight 371.451 g/mol
SMILES C12=C(C(=O)OC(O2)(C)C)CC[n]2c(C(O1)c1ccccc1)ccc2SC
SPLASH splash10-00di-0398000000-5b95596a8c0c1b109043
Source of Spectrum H1-51-836-10
Synonyms 2,2-Dimethyl-8-(methylsulfanyl)-11-phenyl-5,6-dihydro-4H,11H-[1,3]dioxino[5,4-g]pyrrolo[2,1-c][1,4]oxazocin-4-one 8,8-Dimethyl-3-methylsulfanyl-11-phenyl-4,5-dihydro-11H-7,9,10-trioxa-3a-aza-benzo[a]cyclopenta[e]cycloocten-6-one
Wiley ID 817185