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1,1,3,3-Tetramethyl-4'-methoxy-2,3,6,7-tetrahydro-spiro[11H-indene-2,2'-(5'H-(1,3)-thiazepine]-5',6',6'-tricarbonitrile
SpectraBase Compound ID FthCnX9dC7V
InChI InChI=1S/C21H22N4OS/c1-18(2)14-8-6-7-9-15(14)19(3,4)21(18)25-17(26-5)16(10-22)20(11-23,12-24)13-27-21/h6-9,16H,13H2,1-5H3
InChIKey OAUMXRVAPFVXJW-UHFFFAOYSA-N
Mol Weight 378.49 g/mol
Molecular Formula C21H22N4OS
Exact Mass 378.151433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GwbtIqYmmR4
Name 1,1,3,3-Tetramethyl-4'-methoxy-2,3,6,7-tetrahydro-spiro[11H-indene-2,2'-(5'H-(1,3)-thiazepine]-5',6',6'-tricarbonitrile
Alternate Name(s) 1,1,3,3-Tetramethyl-2,3,6',7'-tetrahydro-4'-methoxy-spiro[41H-indene-2,2'-(5'H)-(1,3)-thiazepine]-5',6',6'-tricarbonitrile
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Formula C21H22N4OS
InChI InChI=1S/C21H22N4OS/c1-18(2)14-8-6-7-9-15(14)19(3,4)21(18)25-17(26-5)16(10-22)20(11-23,12-24)13-27-21/h6-9,16H,13H2,1-5H3
InChIKey OAUMXRVAPFVXJW-UHFFFAOYSA-N
Molecular Weight 378.494 g/mol
SMILES C12(N=C(C(C#N)C(CS2)(C#N)C#N)OC)C(c2ccccc2C1(C)C)(C)C
SPLASH splash10-006t-0976000000-204573eb42a861915853
Source of Spectrum H-85-1538-14
Wiley ID 1524271