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1-(1,3-benzodioxol-5-yl)-2-pyrrolidinethione
SpectraBase Compound ID 9Kk40gW26Ea
InChI InChI=1S/C11H11NO2S/c15-11-2-1-5-12(11)8-3-4-9-10(6-8)14-7-13-9/h3-4,6H,1-2,5,7H2
InChIKey IHOMCXTXMNOTGE-UHFFFAOYSA-N
Mol Weight 221.27 g/mol
Molecular Formula C11H11NO2S
Exact Mass 221.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GeGD36L328m
Name 1-(1,3-benzodioxol-5-yl)-2-pyrrolidinethione
Alternate Name(s) 1-(1,3-benzodioxol-5-yl)pyrrolidine-2-thione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2S
InChI InChI=1S/C11H11NO2S/c15-11-2-1-5-12(11)8-3-4-9-10(6-8)14-7-13-9/h3-4,6H,1-2,5,7H2
InChIKey IHOMCXTXMNOTGE-UHFFFAOYSA-N
Molecular Weight 221.274 g/mol
SMILES C1(N(CCC1)c1cc2c(cc1)OCO2)=S
SPLASH splash10-00di-0090000000-c0dddb5a4d688812575b
Source of Spectrum F-57-9640-18
Wiley ID 1626524