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N-Octyl-4-methylbenzylamine
SpectraBase Compound ID 20011FXc2LT
InChI InChI=1S/C16H27N/c1-3-4-5-6-7-8-13-17-14-16-11-9-15(2)10-12-16/h9-12,17H,3-8,13-14H2,1-2H3
InChIKey ROBYAETYBMMTQN-UHFFFAOYSA-N
Mol Weight 233.4 g/mol
Molecular Formula C16H27N
Exact Mass 233.21435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HJ8681hVcO
Name N-Octyl-4-methylbenzylamine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 233.214349873 u
Formula C16H27N
InChI InChI=1S/C16H27N/c1-3-4-5-6-7-8-13-17-14-16-11-9-15(2)10-12-16/h9-12,17H,3-8,13-14H2,1-2H3
InChIKey ROBYAETYBMMTQN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 233.399 g/mol
Nominal Mass 233 u
Quality 987
Retention Index 1833
SMILES C1(CNCCCCCCCC)=CC=C(C=C1)C
SPLASH splash10-0a4i-1900000000-9cc5f425dcca9be49262
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-Octyl-4-methylbenzenemethanamine N-(4-methylbenzyl)octan-1-amine
Technique GC/MS
Wiley ID DD2024_004638