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3-(2-Methoxybenzoyl)indole
SpectraBase Compound ID LK5lj2Doq75
InChI InChI=1S/C16H13NO2/c1-19-15-9-5-3-7-12(15)16(18)13-10-17-14-8-4-2-6-11(13)14/h2-10,17H,1H3
InChIKey PTRREJCKNUCEBY-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 Yubg1R7qK
Name 3-(2-Methoxybenzoyl)indole
CAS Registry Number 98647-11-1
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/c1-19-15-9-5-3-7-12(15)16(18)13-10-17-14-8-4-2-6-11(13)14/h2-10,17H,1H3
InChIKey PTRREJCKNUCEBY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 251.285 g/mol
Nominal Mass 251 u
Quality 988
Retention Index 2671
SMILES C=1(C=2C(NC1)=CC=CC2)C(C=1C(=CC=CC1)OC)=O
SPLASH splash10-001l-2940000000-4b53d2d149d406755d83
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Indole,3-(2-methoxybenzoyl) 1H-Indol-3-yl(2-methoxyphenyl)methanone
Technique GC/MS
Wiley ID DD2024_015090