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1-Benzyl-5-methyl-indole
SpectraBase Compound ID 2NtX44KTEpQ
InChI InChI=1S/C16H15N/c1-13-7-8-16-15(11-13)9-10-17(16)12-14-5-3-2-4-6-14/h2-11H,12H2,1H3
InChIKey UAXORUSBKLNRMJ-UHFFFAOYSA-N
Mol Weight 221.3 g/mol
Molecular Formula C16H15N
Exact Mass 221.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVwhTx5CJI8
Name 1-Benzyl-5-methylindole
Classification Pharmaceutical drug intermediate
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 221.120449487 u
Formula C16H15N
InChI InChI=1S/C16H15N/c1-13-7-8-16-15(11-13)9-10-17(16)12-14-5-3-2-4-6-14/h2-11H,12H2,1H3
InChIKey UAXORUSBKLNRMJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 221.303 g/mol
Nominal Mass 221 u
Quality 987
Retention Index 1949
SMILES C1=2N(CC=3C=CC=CC3)C=CC1=CC(=CC2)C
SPLASH splash10-00dl-9470000000-978b631fbb9779be805b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Indole,1-benzyl-5-methyl 1-Benzyl-5-methyl-1H-indole
Technique GC/MS
Wiley ID DD2024_017495