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NICKEL, (HAPTO-4-CYCLOOCTA-1,5-DIENE)-[HAPTO-2-(E)-PHENYLSULFONYLACRYLIC ACID, METHYL ESTER]
SpectraBase Compound ID 5UTcdSBye9v
InChI InChI=1S/C7H8O2S.2C4H10.C3H6O2.Ni/c1-10(8,9)7-5-3-2-4-6-7;2*1-3-4-2;1-3(4)5-2;/h2-6H,1H3;2*3-4H2,1-2H3;1-2H3;
InChIKey NCWXURUIKNOVQQ-UHFFFAOYSA-N
Mol Weight 405.22 g/mol
Molecular Formula C18H34NiO4S
Exact Mass 404.153123 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9h65wBDyJjx
Name NICKEL, (HAPTO-4-CYCLOOCTA-1,5-DIENE)-[HAPTO-2-(E)-PHENYLSULFONYLACRYLIC ACID, METHYL ESTER]
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H22NiO4S
InChI InChI=1S/C7H8O2S.2C4H10.C3H6O2.Ni/c1-10(8,9)7-5-3-2-4-6-7;2*1-3-4-2;1-3(4)5-2;/h2-6H,1H3;2*3-4H2,1-2H3;1-2H3;
InChIKey NCWXURUIKNOVQQ-UHFFFAOYSA-N
Instrument Name CH5
Molecular Weight 404.1522
SMILES CS(c1ccccc1)(=O)=O.CCCC.CCCC.[Ni].C(=O)(OC)C
SPLASH splash10-004i-9300000000-298d78475396f0bc9cb9
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany