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2-Methylbenzylamine 4-butylbenzoyl
SpectraBase Compound ID JCpkqmtbFIQ
InChI InChI=1S/C19H23NO/c1-3-4-8-16-10-12-17(13-11-16)19(21)20-14-18-9-6-5-7-15(18)2/h5-7,9-13H,3-4,8,14H2,1-2H3,(H,20,21)
InChIKey RBJGAJPPEGTUAI-UHFFFAOYSA-N
Mol Weight 281.4 g/mol
Molecular Formula C19H23NO
Exact Mass 281.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWnSCTmtqQy
Name 2-Methylbenzylamine 4-butylbenzoyl
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 281.177964364 u
Formula C19H23NO
InChI InChI=1S/C19H23NO/c1-3-4-8-16-10-12-17(13-11-16)19(21)20-14-18-9-6-5-7-15(18)2/h5-7,9-13H,3-4,8,14H2,1-2H3,(H,20,21)
InChIKey RBJGAJPPEGTUAI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 281.399 g/mol
Nominal Mass 281 u
Quality 996
Retention Index 2552
SMILES C=1(C(NCC=2C(=CC=CC2)C)=O)C=CC(=CC1)CCCC
SPLASH splash10-0w2c-4920000000-63e2e521c75ceba870c3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Butyl-N-(2-methylbenzyl)benzamide
Technique GC/MS
Wiley ID DD2024_023751