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(1R,2R,5R)-2-Benzyloxymethyl-2-methyl-5-(2-methyl[1,3]dioxolan-2-yl)-cyclopent-3-enylmethyl acetate
SpectraBase Compound ID W5KLxyCmg
InChI InChI=1S/C21H28O5/c1-16(22)24-14-19-18(21(3)25-11-12-26-21)9-10-20(19,2)15-23-13-17-7-5-4-6-8-17/h4-10,18-19H,11-15H2,1-3H3/t18-,19-,20+/m1/s1
InChIKey DAAUSRVXDYTGAC-AQNXPRMDSA-N
Mol Weight 360.45 g/mol
Molecular Formula C21H28O5
Exact Mass 360.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bav5kqRyIrH
Name (1R,2R,5R)-2-Benzyloxymethyl-2-methyl-5-(2-methyl[1,3]dioxolan-2-yl)-cyclopent-3-enylmethyl acetate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O5
InChI InChI=1S/C21H28O5/c1-16(22)24-14-19-18(21(3)25-11-12-26-21)9-10-20(19,2)15-23-13-17-7-5-4-6-8-17/h4-10,18-19H,11-15H2,1-3H3/t18-,19-,20+/m1/s1
InChIKey DAAUSRVXDYTGAC-AQNXPRMDSA-N
Molecular Weight 360.450 g/mol
SMILES [C@]1(C2(OCCO2)C)(C=C[C@]([C@@]1(COC(=O)C)[H])(COCc1ccccc1)C)[H]
SPLASH splash10-000i-9000000000-07fddc1a7db7b156d042
Source of Spectrum F-59-69-17
Wiley ID 1712080