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2,5-Ditert-butyl-3,4-bis(trifluoromethyl)tetrahydro-3,4-thiophenedicarbonitrile
SpectraBase Compound ID 2OBKf06bzLr
InChI InChI=1S/C16H20F6N2S/c1-11(2,3)9-13(7-23,15(17,18)19)14(8-24,16(20,21)22)10(25-9)12(4,5)6/h9-10H,1-6H3
InChIKey DVGOTELWPHMLFQ-UHFFFAOYSA-N
Mol Weight 386.4 g/mol
Molecular Formula C16H20F6N2S
Exact Mass 386.125139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C32W0RKemkw
Name 2,5-Ditert-butyl-3,4-bis(trifluoromethyl)tetrahydro-3,4-thiophenedicarbonitrile
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20F6N2S
InChI InChI=1S/C16H20F6N2S/c1-11(2,3)9-13(7-23,15(17,18)19)14(8-24,16(20,21)22)10(25-9)12(4,5)6/h9-10H,1-6H3
InChIKey DVGOTELWPHMLFQ-UHFFFAOYSA-N
Molecular Weight 386.400 g/mol
SMILES C1(C(C(C(C)(C)C)SC1C(C)(C)C)(C(F)(F)F)C#N)(C(F)(F)F)C#N
SPLASH splash10-0a4i-9000000000-e0b081fbea8ae89d612b
Source of Spectrum AD-0-2532-0
Synonyms 2,5-Ditert-butyl-3,4-bis(trifluoromethyl)tetrahydrothiophene-3,4-dicarbonitrile 2,5-Ditert-butyl-3,4-bis(trifluoromethyl)thiolane-3,4-dicarbonitrile Thiolane-3,4-dicarbonitrile, 2,5-di-tert-butyl-3,4-bis(trifluoromethyl)-
Wiley ID 1421789