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l-Alanine, N-(3-bromobenzoyl)-, dodecyl ester
SpectraBase Compound ID 9pteLgPOIK1
InChI InChI=1S/C22H34BrNO3/c1-3-4-5-6-7-8-9-10-11-12-16-27-22(26)18(2)24-21(25)19-14-13-15-20(23)17-19/h13-15,17-18H,3-12,16H2,1-2H3,(H,24,25)
InChIKey QIXPKSKLHLFTOZ-UHFFFAOYSA-N
Mol Weight 440.4 g/mol
Molecular Formula C22H34BrNO3
Exact Mass 439.172207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGG3A0OxnnU
Name l-Alanine, N-(3-bromobenzoyl)-, dodecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34BrNO3
InChI InChI=1S/C22H34BrNO3/c1-3-4-5-6-7-8-9-10-11-12-16-27-22(26)18(2)24-21(25)19-14-13-15-20(23)17-19/h13-15,17-18H,3-12,16H2,1-2H3,(H,24,25)
InChIKey QIXPKSKLHLFTOZ-UHFFFAOYSA-N
Molecular Weight 440.422 g/mol
SMILES N(C(c1cc(ccc1)Br)=O)C(C(OCCCCCCCCCCCC)=O)C
SPLASH splash10-004i-0490000000-f46d79abab035f4c58a9
Source of Spectrum NP-15-1562-0
Synonyms 2-[[(3-bromophenyl)-oxomethyl]amino]propanoic acid dodecyl ester Dodecyl 2-[(3-bromobenzoyl)amino]propanoate Dodecyl 2-[(3-bromophenyl)carbonylamino]propanoate
Wiley ID 1112302