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1-Benzyl 2-methyl (1S,2R)-1,2-Cyclohexanedicarboxylate

View entire compound with spectra: 1 MS (GC)

1-Benzyl 2-methyl (1S,2R)-1,2-Cyclohexanedicarboxylate
SpectraBase Compound ID J9OPh1Mvt7k
InChI InChI=1S/C16H20O4/c1-19-15(17)13-9-5-6-10-14(13)16(18)20-11-12-7-3-2-4-8-12/h2-4,7-8,13-14H,5-6,9-11H2,1H3/t13-,14+/m1/s1
InChIKey UJUTVQOGTGSBET-KGLIPLIRSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BfATghbsqUP
Name 1-Benzyl 2-methyl (1S,2R)-1,2-Cyclohexanedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-19-15(17)13-9-5-6-10-14(13)16(18)20-11-12-7-3-2-4-8-12/h2-4,7-8,13-14H,5-6,9-11H2,1H3/t13-,14+/m1/s1
InChIKey UJUTVQOGTGSBET-KGLIPLIRSA-N
Molecular Weight 276.332 g/mol
SMILES C([C@@]1([C@](C(=O)OC)(CCCC1)[H])[H])(OCc1ccccc1)=O
SPLASH splash10-056u-9100000000-3f77140dce6949dc57ae
Source of Spectrum AJ-66-2029-3
Wiley ID 771990