For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-[(p-Chlorophenyl)thio]-3'-ethyl-5',6',7',8'-tetrahydro-5',5',8',8'-tetramethyl-2'-acetonaphthone

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

2-[(p-Chlorophenyl)thio]-3'-ethyl-5',6',7',8'-tetrahydro-5',5',8',8'-tetramethyl-2'-acetonaphthone
SpectraBase Compound ID 3MkmTrRuRlq
InChI InChI=1S/C24H29ClOS/c1-6-16-13-20-21(24(4,5)12-11-23(20,2)3)14-19(16)22(26)15-27-18-9-7-17(25)8-10-18/h7-10,13-14H,6,11-12,15H2,1-5H3
InChIKey UNYVNXYPAVAMAK-UHFFFAOYSA-N
Mol Weight 401.01 g/mol
Molecular Formula C24H29ClOS
Exact Mass 400.162764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4JSrw8mwbu3
Name 2-[(p-Chlorophenyl)thio]-3'-ethyl-5',6',7',8'-tetrahydro-5',5',8',8'-tetramethyl-2'-acetonaphthone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.162764427 u
Formula C24H29ClOS
InChI InChI=1S/C24H29ClOS/c1-6-16-13-20-21(24(4,5)12-11-23(20,2)3)14-19(16)22(26)15-27-18-9-7-17(25)8-10-18/h7-10,13-14H,6,11-12,15H2,1-5H3
InChIKey UNYVNXYPAVAMAK-UHFFFAOYSA-N
Molecular Weight 401.008 g/mol
SMILES C=1C(=C(C=C2C(CCC(C12)(C)C)(C)C)CC)C(CSC=1C=CC(=CC1)Cl)=O