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(3aR,5aR,8aS,8bS)-8a-(1,3-benzodioxol-5-yl)-2,2-dimethyl-3a,4,5,5a,6,7,8,8b-octahydro-[1,3]dioxolo[4,5-e]indole
SpectraBase Compound ID C7rHUlSuMVH
InChI InChI=1S/C18H23NO4/c1-17(2)22-13-5-6-15-18(7-8-19-15,16(13)23-17)11-3-4-12-14(9-11)21-10-20-12/h3-4,9,13,15-16,19H,5-8,10H2,1-2H3/t13-,15-,16-,18+/m1/s1
InChIKey MSNZSNKZZZBNJV-IIVZCXTMSA-N
Mol Weight 317.38 g/mol
Molecular Formula C18H23NO4
Exact Mass 317.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LVqku3avEpg
Name (3aR,5aR,8aS,8bS)-8a-(1,3-benzodioxol-5-yl)-2,2-dimethyl-3a,4,5,5a,6,7,8,8b-octahydro-[1,3]dioxolo[4,5-e]indole
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Formula C18H23NO4
InChI InChI=1S/C18H23NO4/c1-17(2)22-13-5-6-15-18(7-8-19-15,16(13)23-17)11-3-4-12-14(9-11)21-10-20-12/h3-4,9,13,15-16,19H,5-8,10H2,1-2H3/t13-,15-,16-,18+/m1/s1
InChIKey MSNZSNKZZZBNJV-IIVZCXTMSA-N
Molecular Weight 317.385 g/mol
SMILES N1CC[C@@]2([C@]1(CC[C@]1(OC(O[C@@]21[H])(C)C)[H])[H])c1cc2OCOc2cc1
SPLASH splash10-0pc0-2192000000-a73f7eca437e955a6474
Source of Spectrum J-63-3616-44
Synonyms (3aR,5aR,8aS,8bS)-8a-(1,3-benzodioxol-5-yl)-2,2-dimethyl-3a,4,5,5a,6,7,8,8b-octahydro-[1,3]dioxol[4,5-e]indole
Wiley ID 1317741