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3-(3-Methoxybenzoyl)indole
SpectraBase Compound ID L32EcAxVU6z
InChI InChI=1S/C16H13NO2/c1-19-12-6-4-5-11(9-12)16(18)14-10-17-15-8-3-2-7-13(14)15/h2-10,17H,1H3
InChIKey MNLUYEDYJLHIQG-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C16H13NO2
Exact Mass 251.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JHICB1leHA
Name 3-(3-Methoxybenzoyl)indole
CAS Registry Number 136672-25-8
Classification Aroylindole cannabinoid designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 251.094628661 u
Formula C16H13NO2
InChI InChI=1S/C16H13NO2/c1-19-12-6-4-5-11(9-12)16(18)14-10-17-15-8-3-2-7-13(14)15/h2-10,17H,1H3
InChIKey MNLUYEDYJLHIQG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 251.285 g/mol
Nominal Mass 251 u
Quality 983
Retention Index 2734
SMILES C=1(C=2C(NC1)=CC=CC2)C(C=1C=C(C=CC1)OC)=O
SPLASH splash10-0006-2930000000-daec03a54f7e104a0aff
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Indole,3-(3-methoxybenzoyl) 1H-Indol-3-yl(3-methoxyphenyl)methanone
Technique GC/MS
Wiley ID DD2024_015091