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Hexylindazolcarbonitril
SpectraBase Compound ID 5E3o82ta1ki
InChI InChI=1S/C14H17N3/c1-2-3-4-7-10-17-14-9-6-5-8-12(14)13(11-15)16-17/h5-6,8-9H,2-4,7,10H2,1H3
InChIKey TYUFVMMVDFGRDD-UHFFFAOYSA-N
Mol Weight 227.31 g/mol
Molecular Formula C14H17N3
Exact Mass 227.142248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFzEJMKWDy4
Name Hexylindazolcarbonitril
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 227.142247559 u
Formula C14H17N3
InChI InChI=1S/C14H17N3/c1-2-3-4-7-10-17-14-9-6-5-8-12(14)13(11-15)16-17/h5-6,8-9H,2-4,7,10H2,1H3
InChIKey TYUFVMMVDFGRDD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 227.311 g/mol
Nominal Mass 227 u
Quality 987
Retention Index 1854
SMILES C=12C(C(=NN2CCCCCC)C#N)=CC=CC1
SPLASH splash10-0a4i-1900000000-8b323f2f6cb41b239b2a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-hexyl-1H-indazole-3-carbonitrile
Technique GC/MS
Wiley ID DD2024_032237