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N-Methyl-N-nosyl-L-isoleucyl-D-alanyl-L-valine Methyl Ester
SpectraBase Compound ID FHz2oDdokCI
InChI InChI=1S/C22H34N4O8S/c1-8-14(4)19(25(6)35(32,33)17-11-9-16(10-12-17)26(30)31)21(28)23-15(5)20(27)24-18(13(2)3)22(29)34-7/h9-15,18-19H,8H2,1-7H3,(H,23,28)(H,24,27)/t14?,15-,18+,19+/m1/s1
InChIKey YXWPZWXACOIKNU-LPISGYMPSA-N
Mol Weight 514.6 g/mol
Molecular Formula C22H34N4O8S
Exact Mass 514.209735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2GAT849PAS
Name N-Methyl-N-nosyl-L-isoleucyl-D-alanyl-L-valine Methyl Ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34N4O8S
InChI InChI=1S/C22H34N4O8S/c1-8-14(4)19(25(6)35(32,33)17-11-9-16(10-12-17)26(30)31)21(28)23-15(5)20(27)24-18(13(2)3)22(29)34-7/h9-15,18-19H,8H2,1-7H3,(H,23,28)(H,24,27)/t14?,15-,18+,19+/m1/s1
InChIKey YXWPZWXACOIKNU-LPISGYMPSA-N
Molecular Weight 514.594 g/mol
SMILES N(C([C@@](N(S(c1ccc(N(=O)=O)cc1)(=O)=O)C)(C(CC)C)[H])=O)[C@@](C(N[C@](C(=O)OC)(C(C)C)[H])=O)(C)[H]
SPLASH splash10-002r-0092000000-66151fc70ea6f13c23e7
Source of Spectrum F-70-3897-11
Wiley ID 1596894