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2-[5-(Phenoxymethyl)-1,3-oxathiolan-2-ylidene]propanedinitrile
SpectraBase Compound ID KbzWgGmbXLj
InChI InChI=1S/C13H10N2O2S/c14-6-10(7-15)13-17-12(9-18-13)8-16-11-4-2-1-3-5-11/h1-5,12H,8-9H2
InChIKey TYOVQUWHOYKWGF-UHFFFAOYSA-N
Mol Weight 258.29 g/mol
Molecular Formula C13H10N2O2S
Exact Mass 258.046299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JbwCurv4cJ5
Name 2-[5-(Phenoxymethyl)-1,3-oxathiolan-2-ylidene]propanedinitrile
Alternate Name(s) 2-(5-(phenoxymethyl)-1,3-oxathiolan-2-ylidene)malononitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N2O2S
InChI InChI=1S/C13H10N2O2S/c14-6-10(7-15)13-17-12(9-18-13)8-16-11-4-2-1-3-5-11/h1-5,12H,8-9H2
InChIKey TYOVQUWHOYKWGF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000231
Molecular Weight 258.295 g/mol
SMILES C(C(C#N)=C1OC(CS1)COc1ccccc1)#N
SPLASH splash10-0gi3-8900000000-5261b07d1add9a7c5565
Source of Spectrum H-94-642-2e
Wiley ID 1785975