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

*Links on SpectraBase are not permalinks.
1,5-bis(bromanyl)-3-(2,6-dinitrophenyl)-2,4-bis(propylsulfanyl)benzene
SpectraBase Compound ID 45ZFAvSXhIn
InChI InChI=1S/C18H18Br2N2O4S2/c1-3-8-27-17-11(19)10-12(20)18(28-9-4-2)16(17)15-13(21(23)24)6-5-7-14(15)22(25)26/h5-7,10H,3-4,8-9H2,1-2H3
InChIKey ZNRXWWTUABWNCR-UHFFFAOYSA-N
Mol Weight 550.28 g/mol
Molecular Formula C18H18Br2N2O4S2
Exact Mass 547.907475 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 DEsU69XiRCc
Name 1,5-bis(bromanyl)-3-(2,6-dinitrophenyl)-2,4-bis(propylsulfanyl)benzene
Alternate Name(s) 1,5-dibromo-3-(2,6-dinitrophenyl)-2,4-bis(propylsulfanyl)benzene 1,5-dibromo-3-(2,6-dinitrophenyl)-2,4-bis(propylthio)benzene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18Br2N2O4S2
InChI InChI=1S/C18H18Br2N2O4S2/c1-3-8-27-17-11(19)10-12(20)18(28-9-4-2)16(17)15-13(21(23)24)6-5-7-14(15)22(25)26/h5-7,10H,3-4,8-9H2,1-2H3
InChIKey ZNRXWWTUABWNCR-UHFFFAOYSA-N
Molecular Weight 550.280 g/mol
SMILES c1(-c2c(c(Br)cc(c2SCCC)Br)SCCC)c(N(=O)=O)cccc1N(=O)=O
SPLASH splash10-03di-0090060000-572c534dc0f282e006c9
Source of Spectrum F-68-9586-44
Wiley ID 1573839