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2-(1,1,2,3,3-Pentamethyl-indanyl-6)-1-(3-carboxy-isoxazolyl-5)-(E)-propene

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2-(1,1,2,3,3-Pentamethyl-indanyl-6)-1-(3-carboxy-isoxazolyl-5)-(E)-propene
SpectraBase Compound ID LHzsTCyAuGL
InChI InChI=1S/C21H25NO3/c1-12(9-15-11-18(19(23)24)22-25-15)14-7-8-16-17(10-14)21(5,6)13(2)20(16,3)4/h7-11,13H,1-6H3,(H,23,24)/b12-9+
InChIKey PEBBPBYOWGGOSK-FMIVXFBMSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FHFGu3EIhnK
Name 2-(1,1,2,3,3-Pentamethyl-indanyl-6)-1-(3-carboxy-isoxazolyl-5)-(E)-propene
CAS Registry Number 104192-01-0
Comments WHE-6896-46, MIXTURE WITH 20 % CIS
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-12(9-15-11-18(19(23)24)22-25-15)14-7-8-16-17(10-14)21(5,6)13(2)20(16,3)4/h7-11,13H,1-6H3,(H,23,24)/b12-9+
InChIKey PEBBPBYOWGGOSK-FMIVXFBMSA-N
Instrument Name Bruker WP-80
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6