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(1R,2S)-cis-2-Benzyloxycarbonyl-4,4-dimethylcyclopentane-1-carboxylic acid
SpectraBase Compound ID 1e40NOzkANo
InChI InChI=1S/C16H20O4/c1-16(2)8-12(14(17)18)13(9-16)15(19)20-10-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3,(H,17,18)/t12-,13+/m1/s1
InChIKey YJNPROMOISQKBA-OLZOCXBDSA-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 LluaRULOfpt
Name (1R,2S)-cis-2-Benzyloxycarbonyl-4,4-dimethylcyclopentane-1-carboxylic acid
Alternate Name(s) (1R,2S)-2-[(benzyloxy)carbonyl]-4,4-dimethylcyclopentanecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-16(2)8-12(14(17)18)13(9-16)15(19)20-10-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3,(H,17,18)/t12-,13+/m1/s1
InChIKey YJNPROMOISQKBA-OLZOCXBDSA-N
Molecular Weight 276.332 g/mol
SMILES OC([C@]1([C@@](C(OCc2ccccc2)=O)(CC(C)(C)C1)[H])[H])=O
SPLASH splash10-0a4l-5900000000-1830de6cdfde9b17d9f0
Source of Spectrum KD-14-3462-16
Wiley ID 1636519