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

*Links on SpectraBase are not permalinks.
(E)-1-N'-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine
SpectraBase Compound ID K7smmFENDvH
InChI InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+
InChIKey VMXUWOKSQNHOCA-UKTHLTGXSA-N
Mol Weight 314.4 g/mol
Molecular Formula C13H22N4O3S
Exact Mass 314.141262 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 Hc9RNyDfIFk
Name RANITIDINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H22N4O3S
InChI InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+
InChIKey VMXUWOKSQNHOCA-UKTHLTGXSA-N
Instrument Name FLASH-DI
Molecular Weight 314.404 g/mol
SMILES N(\C(=C\N(=O)=O)NC)CCSCc1ccc(CN(C)C)o1
SPLASH splash10-0a4u-9710000000-a9bd35dd227b5a553779
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany