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2-(methylsulfanyl)-N-(6-propyl-1,3-benzodioxol-5-yl)benzamide
SpectraBase Compound ID LQ5ExhSKL3g
InChI InChI=1S/C18H19NO3S/c1-3-6-12-9-15-16(22-11-21-15)10-14(12)19-18(20)13-7-4-5-8-17(13)23-2/h4-5,7-10H,3,6,11H2,1-2H3,(H,19,20)
InChIKey BOSDIIWNSAEMAJ-UHFFFAOYSA-N
Mol Weight 329.41 g/mol
Molecular Formula C18H19NO3S
Exact Mass 329.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5L3GHawlxRA
Name 2-(methylsulfanyl)-N-(6-propyl-1,3-benzodioxol-5-yl)benzamide
Alternate Name(s) 2-(methylthio)-N-(6-propyl-1,3-benzodioxol-5-yl)benzamide Benzamide, 2-methylsulfanyl-N-(6-propylbenzo[1,3]dioxol-5-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO3S
InChI InChI=1S/C18H19NO3S/c1-3-6-12-9-15-16(22-11-21-15)10-14(12)19-18(20)13-7-4-5-8-17(13)23-2/h4-5,7-10H,3,6,11H2,1-2H3,(H,19,20)
InChIKey BOSDIIWNSAEMAJ-UHFFFAOYSA-N
Molecular Weight 329.414 g/mol
SMILES N(C(=O)c1c(cccc1)SC)c1cc2c(cc1CCC)OCO2
SPLASH splash10-0udi-3902000000-6e4096599b0d1f893861
Wiley ID 1438688