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3-(4-Methoxybenzoyl)indole
SpectraBase Compound ID 6GGSwmyQZp5
InChI InChI=1S/C16H13NO2/c1-19-12-8-6-11(7-9-12)16(18)14-10-17-15-5-3-2-4-13(14)15/h2-10,17H,1H3
InChIKey KLNHIIYKFBCQQB-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 2pWFRoxNlke
Name 3-(4-Methoxybenzoyl)indole
CAS Registry Number 22051-15-6
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/c1-19-12-8-6-11(7-9-12)16(18)14-10-17-15-5-3-2-4-13(14)15/h2-10,17H,1H3
InChIKey KLNHIIYKFBCQQB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 251.285 g/mol
Nominal Mass 251 u
Quality 953
Retention Index 2786
SMILES C=1(C=2C(NC1)=CC=CC2)C(C=1C=CC(=CC1)OC)=O
SPLASH splash10-0f6x-2960000000-5af5f2c5371aa6f9bd06
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-(4-Anisoyl)indole 1H-Indol-3-yl(4-methoxyphenyl)methanone
Technique GC/MS
Wiley ID DD2024_015092