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3-Thietanecarbonitrile, 2,2-bis(4-methoxyphenyl)-
SpectraBase Compound ID 3OSBnGTmxTh
InChI InChI=1S/C18H17NO2S/c1-20-16-7-3-13(4-8-16)18(15(11-19)12-22-18)14-5-9-17(21-2)10-6-14/h3-10,15H,12H2,1-2H3
InChIKey UARYMXBFSGUEGO-UHFFFAOYSA-N
Mol Weight 311.4 g/mol
Molecular Formula C18H17NO2S
Exact Mass 311.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQrjsrnUUwG
Name 3-Thietanecarbonitrile, 2,2-bis(4-methoxyphenyl)-
CAS Registry Number 53378-09-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO2S
InChI InChI=1S/C18H17NO2S/c1-20-16-7-3-13(4-8-16)18(15(11-19)12-22-18)14-5-9-17(21-2)10-6-14/h3-10,15H,12H2,1-2H3
InChIKey UARYMXBFSGUEGO-UHFFFAOYSA-N
Molecular Weight 311.399 g/mol
SMILES C1(SCC1C#N)(c1ccc(cc1)OC)c1ccc(cc1)OC
SPLASH splash10-0a7i-9180000000-209b74ae76ac25b8ede9
Source of Spectrum K-107-1867-20
Synonyms 2,2-bis(4-methoxyphenyl)-3-thietanecarbonitrile
Wiley ID 1312448