SpectraBase Compound ID | BGQtZCa6Pav |
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InChI | InChI=1S/C15H22N2O5S/c1-3-22-15(19)11-16-14(18)5-4-10-17-23(20,21)13-8-6-12(2)7-9-13/h6-9,17H,3-5,10-11H2,1-2H3,(H,16,18) |
InChIKey | QYYTXOFOUMFIFT-UHFFFAOYSA-N |
Mol Weight | 342.41 g/mol |
Molecular Formula | C15H22N2O5S |
Exact Mass | 342.124943 g/mol |
SpectraBase Spectrum ID | 986WYXK7irb |
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Name | N-[4-(N-Tosylamino)butyryl]glycine, ethyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 342.124942985 u |
Formula | C15H22N2O5S |
InChI | InChI=1S/C15H22N2O5S/c1-3-22-15(19)11-16-14(18)5-4-10-17-23(20,21)13-8-6-12(2)7-9-13/h6-9,17H,3-5,10-11H2,1-2H3,(H,16,18) |
InChIKey | QYYTXOFOUMFIFT-UHFFFAOYSA-N |
Molecular Weight | 342.410 g/mol |
SMILES | C1(=CC=C(C=C1)C)S(=O)(=O)NCCCC(NCC(OCC)=O)=O |