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tert-butyl 1,2,3,4,4a,9a-hexahydrocarbazole-9-carboxylate
SpectraBase Compound ID JCtqiGxN2Rt
InChI InChI=1S/C17H23NO2/c1-17(2,3)20-16(19)18-14-10-6-4-8-12(14)13-9-5-7-11-15(13)18/h4,6,8,10,13,15H,5,7,9,11H2,1-3H3
InChIKey GSWOQJZYPPYENG-UHFFFAOYSA-N
Mol Weight 273.38 g/mol
Molecular Formula C17H23NO2
Exact Mass 273.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HK0oQZqIo03
Name tert-butyl 1,2,3,4,4a,9a-hexahydrocarbazole-9-carboxylate
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.172878983 u
Formula C17H23NO2
InChI InChI=1S/C17H23NO2/c1-17(2,3)20-16(19)18-14-10-6-4-8-12(14)13-9-5-7-11-15(13)18/h4,6,8,10,13,15H,5,7,9,11H2,1-3H3
InChIKey GSWOQJZYPPYENG-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704260
Quality 120
SMILES C1=CC2=C(C=C1)N(C1C2CCCC1)C(OC(C)(C)C)=O
SPLASH splash10-014i-1390000000-066acfd750fa7231c36e
Source of Spectrum ACI-56-SM52-30 (DOI: 10.1002/anie.201704260)
Thin-Layer Chromatography 0.48 (petroleum ether/ethyl acetate, 10:1)
Wiley ID 1896298