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3-(N-Tosyl)-4-(benzoylmethyl)pentanol
SpectraBase Compound ID CTExLiju2Ny
InChI InChI=1S/C20H27NO4S/c1-16-8-10-19(11-9-16)26(23,24)21-20(12-13-22)17(2)14-25-15-18-6-4-3-5-7-18/h3-11,17,20-22H,12-15H2,1-2H3/t17-,20-/m0/s1
InChIKey BHTCQIFOPIQTFO-PXNSSMCTSA-N
Mol Weight 377.5 g/mol
Molecular Formula C20H27NO4S
Exact Mass 377.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2q3oJV12yl
Name 3-(N-Tosyl)-4-(benzoylmethyl)pentanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO4S
InChI InChI=1S/C20H27NO4S/c1-16-8-10-19(11-9-16)26(23,24)21-20(12-13-22)17(2)14-25-15-18-6-4-3-5-7-18/h3-11,17,20-22H,12-15H2,1-2H3/t17-,20-/m0/s1
InChIKey BHTCQIFOPIQTFO-PXNSSMCTSA-N
Molecular Weight 377.499 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@@](CCO)([C@](COCc1ccccc1)(C)[H])[H]
SPLASH splash10-0006-9110000000-c78f871cf5c9ee03f521
Source of Spectrum F-48-6084-8
Wiley ID 1358241