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Methyl 2',2"-di-O-methylgyrophotate
SpectraBase Compound ID EkdzHOnv9pm
InChI InChI=1S/C27H26O10/c1-13-7-16(28)10-20(33-4)23(13)26(31)37-18-9-15(3)24(21(12-18)34-5)27(32)36-17-8-14(2)22(19(29)11-17)25(30)35-6/h7-12,28-29H,1-6H3
InChIKey QWMLYZWXAJBYDH-UHFFFAOYSA-N
Mol Weight 510.5 g/mol
Molecular Formula C27H26O10
Exact Mass 510.152597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CK8NURTFoUc
Name Methyl 2',2''-di-o-methylgyrophotate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 510.152597027 u
Formula C27H26O10
InChI InChI=1S/C27H26O10/c1-13-7-16(28)10-20(33-4)23(13)26(31)37-18-9-15(3)24(21(12-18)34-5)27(32)36-17-8-14(2)22(19(29)11-17)25(30)35-6/h7-12,28-29H,1-6H3
InChIKey QWMLYZWXAJBYDH-UHFFFAOYSA-N
Molecular Weight 510.495 g/mol
SMILES C1(C(OC=2C=C(C(C(=O)OC)=C(C2)C)O)=O)=C(C=C(OC(C=2C(=CC(O)=CC2C)OC)=O)C=C1C)OC