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2-Thiono-2'-isopropyl-psoralen

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2-Thiono-2'-isopropyl-psoralen
SpectraBase Compound ID AsqwMkYN31O
InChI InChI=1S/C14H12O2S/c1-8(2)11-6-10-5-9-3-4-14(17)16-12(9)7-13(10)15-11/h3-8H,1-2H3
InChIKey BZOSBNZRSJVYDB-UHFFFAOYSA-N
Mol Weight 244.31 g/mol
Molecular Formula C14H12O2S
Exact Mass 244.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Goytri7DQ4i
Name 2-Thiono-2'-isopropyl-psoralen
CAS Registry Number 77151-77-0
Comments FROM EARLIER PAPER BY DUDDECK
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H12O2S
InChI InChI=1S/C14H12O2S/c1-8(2)11-6-10-5-9-3-4-14(17)16-12(9)7-13(10)15-11/h3-8H,1-2H3
InChIKey BZOSBNZRSJVYDB-UHFFFAOYSA-N
Literature Reference H. Duddeck, M. Kaiser, Org. Magn. Resonance 20, 55 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6