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(3aR,9bS)-3,3a,4,9b-tetrahydro-1H-chromeno[4,3-b]pyrrole-2,2-dicarboxylic acid diethyl ester
SpectraBase Compound ID 4kwfSwtd0zd
InChI InChI=1S/C17H21NO5/c1-3-21-15(19)17(16(20)22-4-2)9-11-10-23-13-8-6-5-7-12(13)14(11)18-17/h5-8,11,14,18H,3-4,9-10H2,1-2H3/t11-,14-/m0/s1
InChIKey FKJGHGSLHJFUJF-FZMZJTMJSA-N
Mol Weight 319.36 g/mol
Molecular Formula C17H21NO5
Exact Mass 319.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4iEbEfLe2q8
Name (3aR,9bS)-3,3a,4,9b-tetrahydro-1H-chromeno[4,3-b]pyrrole-2,2-dicarboxylic acid diethyl ester
Alternate Name(s) (3aR,9bS)-3,3a,4,9b-tetrahydro-1H-[1]benzopyrano[4,3-b]pyrrole-2,2-dicarboxylic acid diethyl ester Diethyl (3aR,9bS)-3,3a,4,9b-tetrahydro-1H-chromeno[4,3-b]pyrrole-2,2-dicarboxylate
CAS Registry Number 125660-60-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO5
InChI InChI=1S/C17H21NO5/c1-3-21-15(19)17(16(20)22-4-2)9-11-10-23-13-8-6-5-7-12(13)14(11)18-17/h5-8,11,14,18H,3-4,9-10H2,1-2H3/t11-,14-/m0/s1
InChIKey FKJGHGSLHJFUJF-FZMZJTMJSA-N
Molecular Weight 319.357 g/mol
SMILES N1[C@@]2(c3c(OC[C@@]2(CC1(C(=O)OCC)C(=O)OCC)[H])cccc3)[H]
SPLASH splash10-0002-1190000000-528ecf413b26c63e6d21
Source of Spectrum F-45-4661-9
Wiley ID 1319333