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Methyl 4-methyl-2-(3',3',6',6'-tetramethyl-1' (2H),8' (7H)-dioxo-3',4',5',6'-tetrahydro-9H-xanthen-9'-yl)furo[3,2-b]pyrrole-5-carboxylate

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Methyl 4-methyl-2-(3',3',6',6'-tetramethyl-1' (2H),8' (7H)-dioxo-3',4',5',6'-tetrahydro-9H-xanthen-9'-yl)furo[3,2-b]pyrrole-5-carboxylate
SpectraBase Compound ID KB2upX4czvF
InChI InChI=1S/C26H29NO6/c1-25(2)9-15(28)21-19(11-25)33-20-12-26(3,4)10-16(29)22(20)23(21)18-7-13-17(32-18)8-14(27(13)5)24(30)31-6/h7-8,23H,9-12H2,1-6H3
InChIKey UAHOVURRBYBHEA-UHFFFAOYSA-N
Mol Weight 451.52 g/mol
Molecular Formula C26H29NO6
Exact Mass 451.199488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AUyS0BmoD5o
Name Methyl 4-methyl-2-(3',3',6',6'-tetramethyl-1' (2H),8' (7H)-dioxo-3',4',5',6'-tetrahydro-9H-xanthen-9'-yl)furo[3,2-B]pyrrole-5-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.199487652 u
Formula C26H29NO6
InChI InChI=1S/C26H29NO6/c1-25(2)9-15(28)21-19(11-25)33-20-12-26(3,4)10-16(29)22(20)23(21)18-7-13-17(32-18)8-14(27(13)5)24(30)31-6/h7-8,23H,9-12H2,1-6H3
InChIKey UAHOVURRBYBHEA-UHFFFAOYSA-N
Molecular Weight 451.519 g/mol
SMILES C12=C(C=C(N2C)C(=O)OC)OC(=C1)C1C2=C(CC(CC2=O)(C)C)OC2=C1C(CC(C)(C)C2)=O