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FUMARIC ACID, MONOMETHYL ESTER, {(7S)10,10-DIMETHYL-5-THIA-4-AZATRICYCLO[5.2.1.0E3,7]DECAN-5,5-DIOXO}AMID
SpectraBase Compound ID GWco9QEiHhn
InChI InChI=1S/C15H21NO5S/c1-14(2)10-6-7-15(14)9-22(19,20)16(11(15)8-10)12(17)4-5-13(18)21-3/h4-5,10-11H,6-9H2,1-3H3/b5-4+/t10-,11?,15-/m0/s1
InChIKey ASQBHBGLTPTXJG-XXVADQOGSA-N
Mol Weight 327.4 g/mol
Molecular Formula C15H21NO5S
Exact Mass 327.114044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NuF9a9ajj8
Name FUMARIC ACID, MONOMETHYL ESTER, {(7S)10,10-DIMETHYL-5-THIA-4-AZATRICYCLO[5.2.1.0E3,7]DECAN-5,5-DIOXO}AMID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H21O5NS
InChI InChI=1S/C15H21NO5S/c1-14(2)10-6-7-15(14)9-22(19,20)16(11(15)8-10)12(17)4-5-13(18)21-3/h4-5,10-11H,6-9H2,1-3H3/b5-4+/t10-,11?,15-/m0/s1
InChIKey ASQBHBGLTPTXJG-XXVADQOGSA-N
Instrument Name 311A
Molecular Weight 327.1135
SMILES C1[C@@]23CS(=O)(=O)N(C(\C=C\C(OC)=O)=O)C3C[C@@](C2(C)C)(C1)[H]
SPLASH splash10-03di-6920000000-5aba53ee188b7d8a97ab
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany