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10b-[3-(1,3-dithian-2-yl)propyl]-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinolin-3-one
SpectraBase Compound ID LJcN9K1sgfs
InChI InChI=1S/C21H27NO3S2/c1-24-17-13-15-7-10-22-19(23)6-9-21(22,16(15)14-18(17)25-2)8-3-5-20-26-11-4-12-27-20/h6,9,13-14,20H,3-5,7-8,10-12H2,1-2H3
InChIKey PWUZZWSSVRPMRP-UHFFFAOYSA-N
Mol Weight 405.57 g/mol
Molecular Formula C21H27NO3S2
Exact Mass 405.143236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Agr1lxBGFs4
Name 10b-[3-(1,3-dithian-2-yl)propyl]-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinolin-3-one
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Formula C21H27NO3S2
InChI InChI=1S/C21H27NO3S2/c1-24-17-13-15-7-10-22-19(23)6-9-21(22,16(15)14-18(17)25-2)8-3-5-20-26-11-4-12-27-20/h6,9,13-14,20H,3-5,7-8,10-12H2,1-2H3
InChIKey PWUZZWSSVRPMRP-UHFFFAOYSA-N
Molecular Weight 405.571 g/mol
SMILES C12(N(C(=O)C=C2)CCc2c1cc(c(OC)c2)OC)CCCC1SCCCS1
SPLASH splash10-0006-0090000000-459668577974259dcf5d
Source of Spectrum F-54-12377-3
Synonyms 10b-[3-(1,3-dithian-2-yl)propyl]-8,9-dimethoxy-5,6-dihydropyrrol[2,1-a]isoquinolin-3-one
Wiley ID 809205