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1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2-chlorobenzyl)sulfonyl]piperazine
SpectraBase Compound ID 6AVgMpw81N3
InChI InChI=1S/C19H21ClN2O4S/c20-17-4-2-1-3-16(17)13-27(23,24)22-9-7-21(8-10-22)12-15-5-6-18-19(11-15)26-14-25-18/h1-6,11H,7-10,12-14H2
InChIKey HYNLIWOHJBVMEF-UHFFFAOYSA-N
Mol Weight 408.9 g/mol
Molecular Formula C19H21ClN2O4S
Exact Mass 408.091056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BkZvGCpkUh7
Name 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2-chlorobenzyl)sulfonyl]piperazine
Alternate Name(s) 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2-chlorophenyl)methylsulfonyl]piperazine 1-(2-Chlorobenzyl)sulfonyl-4-piperonyl-piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21ClN2O4S
InChI InChI=1S/C19H21ClN2O4S/c20-17-4-2-1-3-16(17)13-27(23,24)22-9-7-21(8-10-22)12-15-5-6-18-19(11-15)26-14-25-18/h1-6,11H,7-10,12-14H2
InChIKey HYNLIWOHJBVMEF-UHFFFAOYSA-N
Molecular Weight 408.900 g/mol
SMILES C1N(CCN(C1)Cc1ccc2c(c1)OCO2)S(=O)(=O)Cc1ccccc1Cl
SPLASH splash10-000i-3930000000-500115a9f73b05cbfd3f
Wiley ID 1444775