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7-(4-Fluorophenyl)-5,6,6A,7-tetrahydronaphtho[2,1-C][1,5]benzothiazepine

View entire compound with spectra: 1 NMR

7-(4-Fluorophenyl)-5,6,6A,7-tetrahydronaphtho[2,1-C][1,5]benzothiazepine
SpectraBase Compound ID 6GFYu8xc3z5
InChI InChI=1S/C23H18FNS/c24-17-12-9-16(10-13-17)23-19-14-11-15-5-1-2-6-18(15)22(19)25-20-7-3-4-8-21(20)26-23/h1-10,12-13,19,23H,11,14H2
InChIKey IKWVUZFIWHXYBO-UHFFFAOYSA-N
Mol Weight 359.46 g/mol
Molecular Formula C23H18FNS
Exact Mass 359.114399 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BNkX2etqVWI
Name 7-(4-Fluorophenyl)-5,6,6A,7-tetrahydronaphtho[2,1-C][1,5]benzothiazepine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.114398921 u
Formula C23H18FNS
InChI InChI=1S/C23H18FNS/c24-17-12-9-16(10-13-17)23-19-14-11-15-5-1-2-6-18(15)22(19)25-20-7-3-4-8-21(20)26-23/h1-10,12-13,19,23H,11,14H2
InChIKey IKWVUZFIWHXYBO-UHFFFAOYSA-N
Molecular Weight 359.462 g/mol
SMILES C1(=CC=C(C=C1)F)C1C2C(C3=CC=CC=C3CC2)=NC2=CC=CC=C2S1