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(1R)-1-[(2R,3S)-[3-(Hydroxymethyl)oxiranyl]methyl]-3-(methoxycarbonyl)-2(Z)-allyl Benzoate
SpectraBase Compound ID 56jN0DUzhhS
InChI InChI=1S/C16H18O6/c1-20-15(18)8-7-12(9-13-14(10-17)22-13)21-16(19)11-5-3-2-4-6-11/h2-8,12-14,17H,9-10H2,1H3/b8-7-/t12-,13+,14-/m0/s1
InChIKey KJPFJIGOLHJDOD-SJAXISAPSA-N
Mol Weight 306.31 g/mol
Molecular Formula C16H18O6
Exact Mass 306.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dzp9ogfVFt
Name (1R)-1-[(2R,3S)-[3-(Hydroxymethyl)oxiranyl]methyl]-3-(methoxycarbonyl)-2(Z)-allyl Benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O6
InChI InChI=1S/C16H18O6/c1-20-15(18)8-7-12(9-13-14(10-17)22-13)21-16(19)11-5-3-2-4-6-11/h2-8,12-14,17H,9-10H2,1H3/b8-7-/t12-,13+,14-/m0/s1
InChIKey KJPFJIGOLHJDOD-SJAXISAPSA-N
Molecular Weight 306.314 g/mol
SMILES OC[C@@]1(O[C@@]1(C[C@@](OC(=O)c1ccccc1)(\C=C/C(=O)OC)[H])[H])[H]
SPLASH splash10-0a6r-6900000000-fd2c1731535da8a6a918
Source of Spectrum J-62-4579-32
Wiley ID 1307956