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6-Benzyloxymethyl-1-cyano-7-methyl-3,6-dihydropyrrolo[3,2-e]indole-2-carboxylic acid ethyl ester
SpectraBase Compound ID I2ylVFNxNbg
InChI InChI=1S/C23H21N3O3/c1-3-29-23(27)22-18(12-24)21-17-11-15(2)26(20(17)10-9-19(21)25-22)14-28-13-16-7-5-4-6-8-16/h4-11,25H,3,13-14H2,1-2H3
InChIKey WQKWBTSGEYFWOX-UHFFFAOYSA-N
Mol Weight 387.44 g/mol
Molecular Formula C23H21N3O3
Exact Mass 387.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UMoeRLIKiK
Name 6-Benzyloxymethyl-1-cyano-7-methyl-3,6-dihydropyrrolo[3,2-e]indole-2-carboxylic acid ethyl ester
Appearance Pale creamy crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21N3O3
InChI InChI=1S/C23H21N3O3/c1-3-29-23(27)22-18(12-24)21-17-11-15(2)26(20(17)10-9-19(21)25-22)14-28-13-16-7-5-4-6-8-16/h4-11,25H,3,13-14H2,1-2H3
InChIKey WQKWBTSGEYFWOX-UHFFFAOYSA-N
Instrument Name AMD-604/AutoSpec Premier
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.9.107
Molecular Weight 387.439 g/mol
Reported Formula C23H21N3O3
SMILES [nH]1c(c(c2c1ccc1c2cc([n]1COCc1ccccc1)C)C#N)C(=O)OCC
SPLASH splash10-000f-8149000000-33a52dab286ed6b005d9
Source of Spectrum BJO-9-SM63-8a
Wiley ID 1865055