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1-Hexyl-1H-indole-2,3-dione
SpectraBase Compound ID 5epKNZzUyLI
InChI InChI=1S/C14H17NO2/c1-2-3-4-7-10-15-12-9-6-5-8-11(12)13(16)14(15)17/h5-6,8-9H,2-4,7,10H2,1H3
InChIKey MPJSZKJLVPUZQF-UHFFFAOYSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUwUZgP2OuG
Name 1-Hexyl-1H-indole-2,3-dione
Classification Isatin hydrazone cannabinoid precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 231.125928789 u
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-2-3-4-7-10-15-12-9-6-5-8-11(12)13(16)14(15)17/h5-6,8-9H,2-4,7,10H2,1H3
InChIKey MPJSZKJLVPUZQF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 231.295 g/mol
Nominal Mass 231 u
Quality 982
Retention Index 1772
SMILES C=12C(C(C(N2CCCCCC)=O)=O)=CC=CC1
SPLASH splash10-00o0-7900000000-ca81885a5f3bb3f9d3ca
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-Hexylisatin
Technique GC/MS
Wiley ID DD2024_032417