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3-(1-(4-Ethylphenyl)-1-propen-1-yl)-1-(hex-2-yl)-2-methyl-1H-indole
SpectraBase Compound ID 34DOSuePiyi
InChI InChI=1S/C26H33N/c1-6-9-12-19(4)27-20(5)26(24-13-10-11-14-25(24)27)23(8-3)22-17-15-21(7-2)16-18-22/h8,10-11,13-19H,6-7,9,12H2,1-5H3/b23-8+
InChIKey QREWKVDDFGVGGI-LIMNOBDPSA-N
Mol Weight 359.6 g/mol
Molecular Formula C26H33N
Exact Mass 359.2613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IInIVNT0KtA
Name 3-(1-(4-Ethylphenyl)-1-propen-1-yl)-1-(hex-2-yl)-2-methyl-1H-indole
Classification Indole cannabinoid side product
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 359.261300067 u
Formula C26H33N
InChI InChI=1S/C26H33N/c1-6-9-12-19(4)27-20(5)26(24-13-10-11-14-25(24)27)23(8-3)22-17-15-21(7-2)16-18-22/h8,10-11,13-19H,6-7,9,12H2,1-5H3/b23-8+
InChIKey QREWKVDDFGVGGI-LIMNOBDPSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 359.557 g/mol
Nominal Mass 359 u
Quality 967
Retention Index 2623
SMILES C=1(C=2C(N(C1C)C(CCCC)C)=CC=CC2)\C(C=1C=CC(=CC1)CC)=C\C
SPLASH splash10-0a59-2469000000-aa7a659c1b0d6c96faa4
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-(1-(4-Ethylphenyl)-1-propen-1-yl)-1-(hex-2-yl)-2-methylindole 3-(1-(4-ethylphenyl)prop-1-en-1-yl)-1-(hexan-2-yl)-2-methyl-1H-indole
Technique GC/MS
Wiley ID DD2024_015674