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(1a-alpha,2alpha,3aS *,9-beta,14b-alpha)-(.+/-.)-9-Acetoxy- 1.2,3,5,6,8,9,14b-octahydro-4H-Cyclopenta[a][1,3]dioxolo[4,5-h][pyrrolo[2,1-b]3]benzazepine-1,2-diol

View entire compound with spectra: 1 MS (GC)

(1a-alpha,2alpha,3aS *,9-beta,14b-alpha)-(.+/-.)-9-Acetoxy- 1.2,3,5,6,8,9,14b-octahydro-4H-Cyclopenta[a][1,3]dioxolo[4,5-h][pyrrolo[2,1-b]3]benzazepine-1,2-diol
SpectraBase Compound ID 5KOATBEuUmp
InChI InChI=1S/C19H23NO6/c1-10(21)26-16-8-20-4-2-3-19(20)7-13(22)18(23)17(19)12-6-15-14(5-11(12)16)24-9-25-15/h5-6,13,16-18,22-23H,2-4,7-9H2,1H3/t13-,16+,17?,18-,19-/m1/s1
InChIKey AGESOQKNSYJOGM-INSZWVCLSA-N
Mol Weight 361.39 g/mol
Molecular Formula C19H23NO6
Exact Mass 361.152537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQRS1upRSDQ
Name (1a-alpha,2alpha,3aS *,9-beta,14b-alpha)-(.+/-.)-9-Acetoxy- 1.2,3,5,6,8,9,14b-octahydro-4H-Cyclopenta[a][1,3]dioxolo[4,5-h][pyrrolo[2,1-b]3]benzazepine-1,2-diol
CAS Registry Number 130609-69-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO6
InChI InChI=1S/C19H23NO6/c1-10(21)26-16-8-20-4-2-3-19(20)7-13(22)18(23)17(19)12-6-15-14(5-11(12)16)24-9-25-15/h5-6,13,16-18,22-23H,2-4,7-9H2,1H3/t13-,16+,17?,18-,19-/m1/s1
InChIKey AGESOQKNSYJOGM-INSZWVCLSA-N
Molecular Weight 361.394 g/mol
SMILES O[C@]1(C2[C@@]3(C[C@]1(O)[H])N(C[C@@](c1c2cc2c(c1)OCO2)(OC(=O)C)[H])CCC3)[H]
SPLASH splash10-0w29-0009000000-ae2a475cdb401b57aeed
Source of Spectrum C-112-9612-38
Wiley ID 1348952