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N-(3-Cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-3-(1,1,2,2-tetrafluoroethoxy)benzamide
SpectraBase Compound ID Ey1nRbJbjQ9
InChI InChI=1S/C19H16F4N2O2S/c20-18(21)19(22,23)27-12-6-4-5-11(9-12)16(26)25-17-14(10-24)13-7-2-1-3-8-15(13)28-17/h4-6,9,18H,1-3,7-8H2,(H,25,26)
InChIKey HRBVMBSGYITYQO-UHFFFAOYSA-N
Mol Weight 412.4 g/mol
Molecular Formula C19H16F4N2O2S
Exact Mass 412.086862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7S96X1XB0sK
Name N-(3-Cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-3-(1,1,2,2-tetrafluoroethoxy)benzamide
Alternate Name(s) Benzamide, N-(5,6,7,8-tetrahydro-3-cyano-4H-cyclohepta[b]thien-2-yl)-3-(1,1,2,2-terafluoroethoxy)- N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(1,1,2,2-tetrafluoroethoxy)benzamide N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[1,1,2,2-tetrakis(fluoranyl)ethoxy]benzamide
CAS Registry Number 309920-93-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16F4N2O2S
InChI InChI=1S/C19H16F4N2O2S/c20-18(21)19(22,23)27-12-6-4-5-11(9-12)16(26)25-17-14(10-24)13-7-2-1-3-8-15(13)28-17/h4-6,9,18H,1-3,7-8H2,(H,25,26)
InChIKey HRBVMBSGYITYQO-UHFFFAOYSA-N
Molecular Weight 412.403 g/mol
SMILES N(C(=O)c1cc(ccc1)OC(C(F)F)(F)F)c1c(c2CCCCCc2s1)C#N
SPLASH splash10-00di-8390100000-0bafa4c1ac9cc6d1e070
Source of Spectrum AD-0-2532-0
Wiley ID 1429591