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1-Pentyl-1H-indole-3-carboxylic acid
SpectraBase Compound ID 4ggzA63i5vC
InChI InChI=1S/C14H17NO2/c1-2-3-6-9-15-10-12(14(16)17)11-7-4-5-8-13(11)15/h4-5,7-8,10H,2-3,6,9H2,1H3,(H,16,17)
InChIKey HAPJUNILBCTRIJ-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 5kPq7MRpIoo
Name 1-Pentyl-1H-indole-3-carboxylic acid
Classification Indolcarboxamide 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/c1-2-3-6-9-15-10-12(14(16)17)11-7-4-5-8-13(11)15/h4-5,7-8,10H,2-3,6,9H2,1H3,(H,16,17)
InChIKey HAPJUNILBCTRIJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 231.295 g/mol
Nominal Mass 231 u
Quality 1000
Retention Index 2323
SMILES OC(C=1C=2C(N(C1)CCCCC)=CC=CC2)=O
SPLASH splash10-0089-0940000000-ad71557196c2bc68089b
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_031315