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Methyl 5-methyl-6-oxo-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-7-carboxylate
SpectraBase Compound ID A62IMYOn1Z6
InChI InChI=1S/C16H17NO3/c1-17-13-9-4-3-6-10(13)11-7-5-8-12(16(19)20-2)15(18)14(11)17/h3-4,6,9,12H,5,7-8H2,1-2H3
InChIKey BRQCIEJXJLLVBM-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C16H17NO3
Exact Mass 271.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLAM9CNoCDM
Name Methyl 5-methyl-6-oxo-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-7-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO3
InChI InChI=1S/C16H17NO3/c1-17-13-9-4-3-6-10(13)11-7-5-8-12(16(19)20-2)15(18)14(11)17/h3-4,6,9,12H,5,7-8H2,1-2H3
InChIKey BRQCIEJXJLLVBM-UHFFFAOYSA-N
Instrument Name Micromass UK Platform II LC-MS
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2395
Molecular Weight 271.316 g/mol
SMILES c12[n](c3c(c2cccc1)CCCC(C3=O)C(OC)=O)C
SPLASH splash10-03k9-0090000000-e55e9106dd5d5d8a0165
Source of Spectrum Y-53-252-7c
Wiley ID 1876316