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Spiro[3H-indole-3,7'(6'H)-[3,6]methano[1H]oxepino[4,3-b]pyrrole], gelsedine deriv.
SpectraBase Compound ID IYy2d5rMifQ
InChI InChI=1S/C19H22N2O4/c1-3-12-15-10-9-25-17(16(15)22)19(8-13(10)20-12)11-6-4-5-7-14(11)21(24-2)18(19)23/h4-7,10,13,15-17,22H,3,8-9H2,1-2H3/t10-,13+,15-,16-,17+,19+/m0/s1
InChIKey FLDAHLDTMBMPJD-VLZQTBSGSA-N
Mol Weight 342.4 g/mol
Molecular Formula C19H22N2O4
Exact Mass 342.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJzQlQg5p8P
Name Spiro[3H-indole-3,7'(6'H)-[3,6]methano[1H]oxepino[4,3-b]pyrrole], gelsedine deriv.
CAS Registry Number 114027-39-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2O4
InChI InChI=1S/C19H22N2O4/c1-3-12-15-10-9-25-17(16(15)22)19(8-13(10)20-12)11-6-4-5-7-14(11)21(24-2)18(19)23/h4-7,10,13,15-17,22H,3,8-9H2,1-2H3/t10-,13+,15-,16-,17+,19+/m0/s1
InChIKey FLDAHLDTMBMPJD-VLZQTBSGSA-N
Molecular Weight 342.395 g/mol
SMILES O[C@]1([C@]2([C@@]3([C@](N=C2CC)(C[C@]2(C(N(OC)c4c2cccc4)=O)[C@@]1(OC3)[H])[H])[H])[H])[H]
SPLASH splash10-03k9-0109000000-bd8690cefa279dbece24
Source of Spectrum F-44-5087-5
Wiley ID 1336563