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1H-[1]Benzothieno[3,2-h][1,5]oxazecine-6(3H)-carbonitrile, 4,5,7,8-tetrahydro-1-phenyl-, (.+-.)-
SpectraBase Compound ID IqbOlVpUysg
InChI InChI=1S/C21H20N2OS/c22-15-23-12-6-14-24-20(16-7-2-1-3-8-16)21-18(11-13-23)17-9-4-5-10-19(17)25-21/h1-5,7-10,20H,6,11-14H2
InChIKey INSINRGJOMOANY-UHFFFAOYSA-N
Mol Weight 348.46 g/mol
Molecular Formula C21H20N2OS
Exact Mass 348.129634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bUUntlbGnR
Name 1H-[1]Benzothieno[3,2-h][1,5]oxazecine-6(3H)-carbonitrile, 4,5,7,8-tetrahydro-1-phenyl-, (.+-.)-
CAS Registry Number 121433-73-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2OS
InChI InChI=1S/C21H20N2OS/c22-15-23-12-6-14-24-20(16-7-2-1-3-8-16)21-18(11-13-23)17-9-4-5-10-19(17)25-21/h1-5,7-10,20H,6,11-14H2
InChIKey INSINRGJOMOANY-UHFFFAOYSA-N
Molecular Weight 348.464 g/mol
SMILES c12c(c3ccccc3s2)CCN(C#N)CCCOC1c1ccccc1
SPLASH splash10-000b-8092000000-5ff147b2965cf9eb1b74
Source of Spectrum B-41-1822-7
Synonyms 1-Phenyl-3,4,5,6,7,8-hexahydro-1H-[1]benzothieno[3,2-h][1,5]oxazecine-6-carbonitrile 6-cyano-1-phenyl-3,4,5,6,7,8-hexahydro-1H-[1]benzothieno[3,2-h][1,5]oxazecine
Wiley ID 1340767