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(3a.alpha.,4aS(*),15b.beta.,15c.alpha.)-(+-)-3a,6,7,10,15b,15c-Hexahydro-2,2-di-methyl-5H-[1,3]dioxolo[4,5-h]-1,3-dioxolo[4,5]cyclopenta[1,2-a]pyrrolo[2,1-b]-[3]benzazepin-9(4H)-one

View entire compound with spectra: 1 MS (GC)

(3a.alpha.,4aS(*),15b.beta.,15c.alpha.)-(+-)-3a,6,7,10,15b,15c-Hexahydro-2,2-di-methyl-5H-[1,3]dioxolo[4,5-h]-1,3-dioxolo[4,5]cyclopenta[1,2-a]pyrrolo[2,1-b]-[3]benzazepin-9(4H)-one
SpectraBase Compound ID GaECeV29shd
InChI InChI=1S/C20H23NO5/c1-19(2)25-15-9-20-4-3-5-21(20)16(22)7-11-6-13-14(24-10-23-13)8-12(11)17(20)18(15)26-19/h6,8,15,17-18H,3-5,7,9-10H2,1-2H3/t15-,17+,18-,20-/m1/s1
InChIKey NXNVPWNACUYVSC-MJKGWSOKSA-N
Mol Weight 357.41 g/mol
Molecular Formula C20H23NO5
Exact Mass 357.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E88gbWbml2K
Name (3a.alpha.,4aS(*),15b.beta.,15c.alpha.)-(+-)-3a,6,7,10,15b,15c-Hexahydro-2,2-di-methyl-5H-[1,3]dioxolo[4,5-h]-1,3-dioxolo[4,5]cyclopenta[1,2-a]pyrrolo[2,1-b]-[3]benzazepin-9(4H)-one
CAS Registry Number 113724-91-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO5
InChI InChI=1S/C20H23NO5/c1-19(2)25-15-9-20-4-3-5-21(20)16(22)7-11-6-13-14(24-10-23-13)8-12(11)17(20)18(15)26-19/h6,8,15,17-18H,3-5,7,9-10H2,1-2H3/t15-,17+,18-,20-/m1/s1
InChIKey NXNVPWNACUYVSC-MJKGWSOKSA-N
Molecular Weight 357.406 g/mol
SMILES [C@]123[C@@](c4c(cc5c(c4)OCO5)CC(N2CCC3)=O)([C@@]2(OC(O[C@@]2(C1)[H])(C)C)[H])[H]
SPLASH splash10-0a4i-0098000000-437caf4ebd11a50e1564
Source of Spectrum C-112-9608-29
Synonyms (3aR,4aR,15bR,15cS)-2,2-dimethyl-3a,6,7,10,15b,15c-hexahydro-5H-[1,3]dioxolo[4',5':4,5]cyclopenta[1,2-a][1,3]dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepin-9(4H)-one
Wiley ID 1346498