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1-[2-[6-(1,3-dithiolan-2-yl)-1,3-benzodioxol-5-yl]ethyl]-5-thioxo-2-pyrrolidinone
SpectraBase Compound ID FOwwACDAToW
InChI InChI=1S/C16H17NO3S3/c18-14-1-2-15(21)17(14)4-3-10-7-12-13(20-9-19-12)8-11(10)16-22-5-6-23-16/h7-8,16H,1-6,9H2
InChIKey HCKLSTZKPDUWAP-UHFFFAOYSA-N
Mol Weight 367.5 g/mol
Molecular Formula C16H17NO3S3
Exact Mass 367.037057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDN4vccSJWu
Name 1-[2-[6-(1,3-dithiolan-2-yl)-1,3-benzodioxol-5-yl]ethyl]-5-thioxo-2-pyrrolidinone
CAS Registry Number 124021-72-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO3S3
InChI InChI=1S/C16H17NO3S3/c18-14-1-2-15(21)17(14)4-3-10-7-12-13(20-9-19-12)8-11(10)16-22-5-6-23-16/h7-8,16H,1-6,9H2
InChIKey HCKLSTZKPDUWAP-UHFFFAOYSA-N
Molecular Weight 367.496 g/mol
SMILES C1(N(C(CC1)=O)CCc1c(cc2c(c1)OCO2)C1SCCS1)=S
SPLASH splash10-004l-0190000000-71027cf2c84631c98969
Source of Spectrum J-55-834-10
Wiley ID 1352434