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1-(3-Bromobenzyl)-3-(1-(2-methoxyphenyl)-1-propen-1-yl)-2-methyl-1H-indole II
SpectraBase Compound ID F5b57InIoni
InChI InChI=1S/C26H24BrNO/c1-4-21(22-12-6-8-15-25(22)29-3)26-18(2)28(24-14-7-5-13-23(24)26)17-19-10-9-11-20(27)16-19/h4-16H,17H2,1-3H3/b21-4+
InChIKey JPHZQABTILCIEE-IPBDZQFASA-N
Mol Weight 446.39 g/mol
Molecular Formula C26H24BrNO
Exact Mass 445.104127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 324U5oNAu0
Name 1-(3-Bromobenzyl)-3-(1-(2-methoxyphenyl)-1-propen-1-yl)-2-methyl-1H-indole II
Classification Designer drug side product
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 445.104127396 u
Formula C26H24BrNO
InChI InChI=1S/C26H24BrNO/c1-4-21(22-12-6-8-15-25(22)29-3)26-18(2)28(24-14-7-5-13-23(24)26)17-19-10-9-11-20(27)16-19/h4-16H,17H2,1-3H3/b21-4+
InChIKey JPHZQABTILCIEE-IPBDZQFASA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 446.388 g/mol
Nominal Mass 445 u
Quality 947
Retention Index 3171
SMILES C=1(\C(C=2C(=CC=CC2)OC)=C\C)C=2C(N(C1C)CC=1C=C(C=CC1)Br)=CC=CC2
SPLASH splash10-00kb-2531900000-a0569991e19fe5307a5b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(3-bromobenzyl)-3-(1-(2-methoxyphenyl)prop-1-en-1-yl)-2-methyl-1H-indole
Technique GC/MS
Wiley ID DD2024_015584