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1,3-Diacetylindole
SpectraBase Compound ID 3eZAXuf387t
InChI InChI=1S/C12H11NO2/c1-8(14)11-7-13(9(2)15)12-6-4-3-5-10(11)12/h3-7H,1-2H3
InChIKey STUZJORZRZCLRI-UHFFFAOYSA-N
Mol Weight 201.22 g/mol
Molecular Formula C12H11NO2
Exact Mass 201.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mPGOOMVVL6
Name 3-Indolylmethylketone AC
CAS Registry Number 17537-64-3
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 201.078978596 u
Formula C12H11NO2
InChI InChI=1S/C12H11NO2/c1-8(14)11-7-13(9(2)15)12-6-4-3-5-10(11)12/h3-7H,1-2H3
InChIKey STUZJORZRZCLRI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 201.225 g/mol
Nominal Mass 201 u
Quality 992
Retention Index 1568
SMILES C=12C(N(C=C2C(=O)C)C(=O)C)=CC=CC1
SPLASH splash10-0006-3910000000-a07a6f38058e2578f525
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(1H-Indol-3-yl)ethanone AC 1-(1-acetyl-1H-indol-3-yl)ethan-1-one
Technique GC/MS
Wiley ID DD2024_005528