For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-dichlorophenyl)sulfonyl]piperazine
SpectraBase Compound ID LQDpzlCfybE
InChI InChI=1S/C18H18Cl2N2O4S/c19-14-2-3-15(20)18(10-14)27(23,24)22-7-5-21(6-8-22)11-13-1-4-16-17(9-13)26-12-25-16/h1-4,9-10H,5-8,11-12H2
InChIKey YCBMQKZFUNXSMN-UHFFFAOYSA-N
Mol Weight 429.32 g/mol
Molecular Formula C18H18Cl2N2O4S
Exact Mass 428.036434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IhUwpTevHua
Name 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-dichlorophenyl)sulfonyl]piperazine
Alternate Name(s) 1-(1,3-benzodioxol-5-ylmethyl)-4-[2,5-bis(chloranyl)phenyl]sulfonyl-piperazine 1-(2,5-dichlorophenyl)sulfonyl-4-piperonyl-piperazine 1-Benzo[1,3]dioxol-5-ylmethyl-4-(2,5-dichloro-benzenesulfonyl)-piperazine 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,5-dichlorophenyl)sulfonylpiperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18Cl2N2O4S
InChI InChI=1S/C18H18Cl2N2O4S/c19-14-2-3-15(20)18(10-14)27(23,24)22-7-5-21(6-8-22)11-13-1-4-16-17(9-13)26-12-25-16/h1-4,9-10H,5-8,11-12H2
InChIKey YCBMQKZFUNXSMN-UHFFFAOYSA-N
Molecular Weight 429.318 g/mol
SMILES c1cc(c(S(N2CCN(CC2)Cc2cc3OCOc3cc2)(=O)=O)cc1Cl)Cl
SPLASH splash10-000i-7920000000-c7697e4561939ca52203
Wiley ID 1445241