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1-Acetyl-3-[2-methyl-4,4-bis(ethoxycarbonyl)cyclopentenyl]indole
SpectraBase Compound ID 3bO7cWWIRtU
InChI InChI=1S/C22H25NO5/c1-5-27-20(25)22(21(26)28-6-2)11-14(3)17(12-22)18-13-23(15(4)24)19-10-8-7-9-16(18)19/h7-10,13H,5-6,11-12H2,1-4H3
InChIKey DUKIZWFNCZYHMK-UHFFFAOYSA-N
Mol Weight 383.44 g/mol
Molecular Formula C22H25NO5
Exact Mass 383.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9V1pqwSCbky
Name 1-Acetyl-3-[2-methyl-4,4-bis(ethoxycarbonyl)cyclopentenyl]indole
Alternate Name(s) Diethyl 3-(1-acetyl-1H-indol-3-yl)-4-methyl-3-cyclopentene-1,1-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO5
InChI InChI=1S/C22H25NO5/c1-5-27-20(25)22(21(26)28-6-2)11-14(3)17(12-22)18-13-23(15(4)24)19-10-8-7-9-16(18)19/h7-10,13H,5-6,11-12H2,1-4H3
InChIKey DUKIZWFNCZYHMK-UHFFFAOYSA-N
Molecular Weight 383.444 g/mol
SMILES C1(CC(c2c[n](C(=O)C)c3c2cccc3)=C(C1)C)(C(=O)OCC)C(=O)OCC
SPLASH splash10-05o3-4359000000-3bb35e40570eda34569f
Source of Spectrum F-52-11499-25
Wiley ID 798343