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N-(3,4-dimethoxyphenethyl)-m-toluamide
SpectraBase Compound ID CktuwJAcCrc
InChI InChI=1S/C18H21NO3/c1-13-5-4-6-15(11-13)18(20)19-10-9-14-7-8-16(21-2)17(12-14)22-3/h4-8,11-12H,9-10H2,1-3H3,(H,19,20)
InChIKey GWHBBWOBMXQBDJ-UHFFFAOYSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GhgWNm98CW
Name N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-methylbenzamide
CAS Registry Number 142209-42-5
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 299.152143537 u
Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-13-5-4-6-15(11-13)18(20)19-10-9-14-7-8-16(21-2)17(12-14)22-3/h4-8,11-12H,9-10H2,1-3H3,(H,19,20)
InChIKey GWHBBWOBMXQBDJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 299.370 g/mol
Nominal Mass 299 u
Quality 996
Retention Index 2647
SMILES C=1(C(NCCC2=CC(=C(C=C2)OC)OC)=O)C=C(C=CC1)C
SPLASH splash10-03di-1900000000-74f42e721beec8f196d2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Benzamide,3-methyl-N-(2,3-dimethoxyphenethyl)-
Technique GC/MS
Wiley ID DD2024_023194