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2(S)-Amino-4-methyl-pentanoic acid dioctylamide
SpectraBase Compound ID HdNVds30EuI
InChI InChI=1S/C22H46N2O/c1-5-7-9-11-13-15-17-24(18-16-14-12-10-8-6-2)22(25)21(23)19-20(3)4/h20-21H,5-19,23H2,1-4H3/t21-/m0/s1
InChIKey NCKZCMJFOHPRKI-NRFANRHFSA-N
Mol Weight 354.6 g/mol
Molecular Formula C22H46N2O
Exact Mass 354.361014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5V5IwFe39En
Name 2(S)-Amino-4-methyl-pentanoic acid dioctylamide
Alternate Name(s) (S)-2-amino-4-methyl-N,N-dioctylpentanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H46N2O
InChI InChI=1S/C22H46N2O/c1-5-7-9-11-13-15-17-24(18-16-14-12-10-8-6-2)22(25)21(23)19-20(3)4/h20-21H,5-19,23H2,1-4H3/t21-/m0/s1
InChIKey NCKZCMJFOHPRKI-NRFANRHFSA-N
Literature Reference DOI 10.1002/adsc.201000419
Molecular Weight 354.623 g/mol
SMILES N[C@](C(=O)N(CCCCCCCC)CCCCCCCC)(CC(C)C)[H]
SPLASH splash10-000i-9110000000-364886d2a48e8db5c3dd
Source of Spectrum ASC-352-2421/SM4-8b
Wiley ID 1764000