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2'-ISOPROPYLPSORALEN,(ANHYDROMARMESIN)
SpectraBase Compound ID Im4XlozKwMS
InChI InChI=1S/C14H12O3/c1-8(2)11-6-10-5-9-3-4-14(15)17-12(9)7-13(10)16-11/h3-8H,1-2H3
InChIKey KVHBNBMOEQQULB-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C14H12O3
Exact Mass 228.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AbAVjtCDXJO
Name Anhydro-marmesan
CAS Registry Number 1215-38-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H12O3
InChI InChI=1S/C14H12O3/c1-8(2)11-6-10-5-9-3-4-14(15)17-12(9)7-13(10)16-11/h3-8H,1-2H3
InChIKey KVHBNBMOEQQULB-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference M. Elgamal, N. Elewa, Phytochem. 18, 139 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3