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1-Acetoxy-3-(N-acetylbenzylamino)-2-(p-tolylthio)-propane
SpectraBase Compound ID GdSr8v8lSfM
InChI InChI=1S/C21H25NO3S/c1-16-9-11-20(12-10-16)26-21(15-25-18(3)24)14-22(17(2)23)13-19-7-5-4-6-8-19/h4-12,21H,13-15H2,1-3H3
InChIKey LWFZSGOMHZCNMU-UHFFFAOYSA-N
Mol Weight 371.5 g/mol
Molecular Formula C21H25NO3S
Exact Mass 371.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4RrRdGCmtKo
Name 1-Acetoxy-3-(N-acetylbenzylamino)-2-(p-tolylthio)-propane
Alternate Name(s) 3-[acetyl(benzyl)amino]-2-[(4-methylphenyl)sulfanyl]propyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO3S
InChI InChI=1S/C21H25NO3S/c1-16-9-11-20(12-10-16)26-21(15-25-18(3)24)14-22(17(2)23)13-19-7-5-4-6-8-19/h4-12,21H,13-15H2,1-3H3
InChIKey LWFZSGOMHZCNMU-UHFFFAOYSA-N
Molecular Weight 371.495 g/mol
SMILES C(N(CC(Sc1ccc(cc1)C)COC(=O)C)Cc1ccccc1)(=O)C
SPLASH splash10-0006-9320000000-49db1da65ecba681faf6
Source of Spectrum H-60-1690-0
Wiley ID 1354984