Debug Info

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JG2R2LPEJsW
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JG2R2LPEJsW
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3-Methyl-N-(2-phenylpropyl)benzamide
SpectraBase Compound ID JmfqMdKilV5
InChI InChI=1S/C17H19NO/c1-13-7-6-10-16(11-13)17(19)18-12-14(2)15-8-4-3-5-9-15/h3-11,14H,12H2,1-2H3,(H,18,19)
InChIKey GPCVQNGCFUINMB-UHFFFAOYSA-N
Mol Weight 253.34 g/mol
Molecular Formula C17H19NO
Exact Mass 253.146664 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JG2R2LPEJsW
Name 3-Methyl-N-(2-phenylpropyl)benzamide
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 253.146664235 u
Formula C17H19NO
InChI InChI=1S/C17H19NO/c1-13-7-6-10-16(11-13)17(19)18-12-14(2)15-8-4-3-5-9-15/h3-11,14H,12H2,1-2H3,(H,18,19)
InChIKey GPCVQNGCFUINMB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 253.345 g/mol
Nominal Mass 253 u
Quality 951
Retention Index 2230
SMILES C=1(C(NCC(C2=CC=CC=C2)C)=O)C=C(C=CC1)C
SPLASH splash10-014i-2910000000-d72bb5a8dc16dfded38b
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_023193
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