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2-(benzylamino)-4-methyl-valeric acid methyl ester

View entire compound with spectra: 1 MS (GC)

2-(benzylamino)-4-methyl-valeric acid methyl ester
SpectraBase Compound ID AV8tv7N2hg0
InChI InChI=1S/C14H21NO2/c1-11(2)9-13(14(16)17-3)15-10-12-7-5-4-6-8-12/h4-8,11,13,15H,9-10H2,1-3H3
InChIKey LITWZVHRFAQHQA-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpTLtU51LmL
Name 2-(benzylamino)-4-methyl-valeric acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-11(2)9-13(14(16)17-3)15-10-12-7-5-4-6-8-12/h4-8,11,13,15H,9-10H2,1-3H3
InChIKey LITWZVHRFAQHQA-UHFFFAOYSA-N
Molecular Weight 235.327 g/mol
SMILES N(C(C(=O)OC)CC(C)C)Cc1ccccc1
SPLASH splash10-004l-6900000000-d7a5f108dedf74150c78
Source of Spectrum I-80-784-7
Synonyms 4-Methyl-2-[(phenylmethyl)amino]pentanoic acid methyl ester Methyl 2-(benzylamino)-4-methyl-pentanoate Methyl 4-methyl-2-[(phenylmethyl)amino]pentanoate
Wiley ID 1517281