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{5-Methoxy-2-[methyl-((6R,7S)-6-methyl-7-vinyl-1,4-dioxa-spiro[4.4]non-6-ylmethyl)-carbamoyl]-phenyl}-acetic acid methyl ester
SpectraBase Compound ID 6LNFBemzfWw
InChI InChI=1S/C23H31NO6/c1-6-17-9-10-23(29-11-12-30-23)22(17,2)15-24(3)21(26)19-8-7-18(27-4)13-16(19)14-20(25)28-5/h6-8,13,17H,1,9-12,14-15H2,2-5H3/t17-,22+/m1/s1
InChIKey RRFOWUWNELBFPA-VGSWGCGISA-N
Mol Weight 417.5 g/mol
Molecular Formula C23H31NO6
Exact Mass 417.215138 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 384D6Zc1sAz
Name {5-Methoxy-2-[methyl-((6R,7S)-6-methyl-7-vinyl-1,4-dioxa-spiro[4.4]non-6-ylmethyl)-carbamoyl]-phenyl}-acetic acid methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.215137716 u
Formula C23H31NO6
InChI InChI=1S/C23H31NO6/c1-6-17-9-10-23(29-11-12-30-23)22(17,2)15-24(3)21(26)19-8-7-18(27-4)13-16(19)14-20(25)28-5/h6-8,13,17H,1,9-12,14-15H2,2-5H3/t17-,22+/m1/s1
InChIKey RRFOWUWNELBFPA-VGSWGCGISA-N
Molecular Weight 417.502 g/mol
SMILES [C@@]1(C2(OCCO2)CC[C@]1(C=C)[H])(CN(C(C=1C(CC(=O)OC)=CC(=CC1)OC)=O)C)C