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t-Butyl (3R*,5S*,6E)-7-Phenyl-3,5-di(2-tetrahydropyranyloxy)-6-heptenoate
SpectraBase Compound ID IUcLFpqq70y
InChI InChI=1S/C27H40O6/c1-27(2,3)33-24(28)20-23(32-26-14-8-10-18-30-26)19-22(31-25-13-7-9-17-29-25)16-15-21-11-5-4-6-12-21/h4-6,11-12,15-16,22-23,25-26H,7-10,13-14,17-20H2,1-3H3/b16-15+/t22-,23-,25?,26?/m1/s1
InChIKey MUJSGYYOOLEVGL-FOUMPCBESA-N
Mol Weight 460.6 g/mol
Molecular Formula C27H40O6
Exact Mass 460.282489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPfrRjufjhv
Name t-Butyl (3R*,5S*,6E)-7-Phenyl-3,5-di(2-tetrahydropyranyloxy)-6-heptenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40O6
InChI InChI=1S/C27H40O6/c1-27(2,3)33-24(28)20-23(32-26-14-8-10-18-30-26)19-22(31-25-13-7-9-17-29-25)16-15-21-11-5-4-6-12-21/h4-6,11-12,15-16,22-23,25-26H,7-10,13-14,17-20H2,1-3H3/b16-15+/t22-,23-,25?,26?/m1/s1
InChIKey MUJSGYYOOLEVGL-FOUMPCBESA-N
Molecular Weight 460.611 g/mol
SMILES C(C[C@@](C[C@@](\C=C\c1ccccc1)(OC1OCCCC1)[H])(OC1OCCCC1)[H])(OC(C)(C)C)=O
SPLASH splash10-000i-9000000000-4dba48adb00f851482bf
Source of Spectrum AJ-68-2654-9
Synonyms t-Butyl (3S*,5R*,6E)-7-Phenyl-3,5-di(2-tetrahydropyranyloxy)-6-heptenoate tert-Butyl (3R,5S,6E)-7-phenyl-3,5-bis(tetrahydro-2H-pyran-2-yloxy)-6-heptenoate
Wiley ID 773406