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3-Methoxyphenethylamine N,N-bis(4-toluoyl)
SpectraBase Compound ID 6jopyrknr7l
InChI InChI=1S/C25H25NO3/c1-18-7-11-21(12-8-18)24(27)26(25(28)22-13-9-19(2)10-14-22)16-15-20-5-4-6-23(17-20)29-3/h4-14,17H,15-16H2,1-3H3
InChIKey PTSAEIOETVXESL-UHFFFAOYSA-N
Mol Weight 387.48 g/mol
Molecular Formula C25H25NO3
Exact Mass 387.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWCgNsRw2wC
Name 3-Methoxyphenethylamine N,N-bis(4-toluoyl)
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 387.183443666 u
Formula C25H25NO3
InChI InChI=1S/C25H25NO3/c1-18-7-11-21(12-8-18)24(27)26(25(28)22-13-9-19(2)10-14-22)16-15-20-5-4-6-23(17-20)29-3/h4-14,17H,15-16H2,1-3H3
InChIKey PTSAEIOETVXESL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 387.479 g/mol
Nominal Mass 387 u
Quality 1000
Retention Index 2983
SMILES C(N(C(C=1C=CC(=CC1)C)=O)CCC=1C=C(C=CC1)OC)(C1=CC=C(C=C1)C)=O
SPLASH splash10-00lr-2900000000-6bb7cf725fb0d9342c45
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(4-Methylbenzoyl)-N-[2-(3-methoxyphenyl)ethyl]-4-methylbenzamide
Technique GC/MS
Wiley ID DD2024_025080