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beta-Methylphenethylamine m-tolyl
SpectraBase Compound ID CcvF3K1iQ1W
InChI InChI=1S/C17H21N/c1-14-7-6-8-16(11-14)13-18-12-15(2)17-9-4-3-5-10-17/h3-11,15,18H,12-13H2,1-2H3
InChIKey NNMGWWQZBKBTLX-UHFFFAOYSA-N
Mol Weight 239.36 g/mol
Molecular Formula C17H21N
Exact Mass 239.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFBMnyJdbJQ
Name beta-Methylphenethylamine m-tolyl
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 239.167399680 u
Formula C17H21N
InChI InChI=1S/C17H21N/c1-14-7-6-8-16(11-14)13-18-12-15(2)17-9-4-3-5-10-17/h3-11,15,18H,12-13H2,1-2H3
InChIKey NNMGWWQZBKBTLX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 239.362 g/mol
Nominal Mass 239 u
Quality 993
Retention Index 1889
SMILES C=1(CNCC(C=2C=CC=CC2)C)C=C(C=CC1)C
SPLASH splash10-0a59-1900000000-614c77ec1c519e5a1882
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Methylbenzyl)-2-phenylpropan-1-amine
Technique GC/MS
Wiley ID DD2024_022995