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4-Methylbenzylamine BUT
SpectraBase Compound ID 7euiCwWVMv9
InChI InChI=1S/C12H17NO/c1-3-4-12(14)13-9-11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H,13,14)
InChIKey UWHCUSVTMBVVPC-UHFFFAOYSA-N
Mol Weight 191.27 g/mol
Molecular Formula C12H17NO
Exact Mass 191.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZXOBONrQ0G
Name 4-Methylbenzylamine BUT
CAS Registry Number 20172-29-6
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 191.131014170 u
Formula C12H17NO
InChI InChI=1S/C12H17NO/c1-3-4-12(14)13-9-11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H,13,14)
InChIKey UWHCUSVTMBVVPC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 191.274 g/mol
Nominal Mass 191 u
Quality 941
Retention Index 1654
SMILES C=1(CNC(CCC)=O)C=CC(=CC1)C
SPLASH splash10-052f-4900000000-09f0e8a59f3493f4cea9
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N- (4-Methylbenzyl)butanamide p-Butyroxylidide N-(4-Methylbenzyl)butanamide
Technique GC/MS
Wiley ID DD2024_019350