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4-PHENYL-6,7,8,9,10,11-HEXAHYDRO-4H-THIENO-[2,3-H]-[1,5]-OXAZECINE-9-CARBONITRILE
SpectraBase Compound ID 7vRnSKCP8rp
InChI InChI=1S/C17H18N2OS/c18-13-19-9-4-11-20-17(14-5-2-1-3-6-14)15-8-12-21-16(15)7-10-19/h1-3,5-6,8,12,17H,4,7,9-11H2
InChIKey IBVYKYWHOSVFAR-UHFFFAOYSA-N
Mol Weight 298.4 g/mol
Molecular Formula C17H18N2OS
Exact Mass 298.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtbqQwEU1EQ
Name 4H-Thieno[2,3-h][1,5]oxazecine-9(6H)-carbonitrile, 7,8,10,11-tetrahydro-4-phenyl-
Alternate Name(s) 4-Phenyl-6,7,8,9,10,11-hexahydro-4H-thieno[2,3-h][1,5]oxazecine-9-carbnitrile 9-cyano-4-phenyl-6,7,8,9,10,11-hexahydro-4H-thieno[2,3-h][1,5]oxazecine
CAS Registry Number 91477-88-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2OS
InChI InChI=1S/C17H18N2OS/c18-13-19-9-4-11-20-17(14-5-2-1-3-6-14)15-8-12-21-16(15)7-10-19/h1-3,5-6,8,12,17H,4,7,9-11H2
InChIKey IBVYKYWHOSVFAR-UHFFFAOYSA-N
Molecular Weight 298.404 g/mol
SMILES c12c(scc2)CCN(C#N)CCCOC1c1ccccc1
SPLASH splash10-000b-3920000000-c0337820841fb3a1508e
Source of Spectrum B-37-1046-0
Wiley ID 1300977