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(1R,2S,6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxy-1-cyclohex-3-enecarboxylic acid ethyl ester
SpectraBase Compound ID GirB86pTaJq
InChI InChI=1S/C14H22O5/c1-4-17-13(16)12-9(6-5-7-10(12)15)11-8-18-14(2,3)19-11/h5,7,9-12,15H,4,6,8H2,1-3H3/t9-,10-,11+,12+/m0/s1
InChIKey UWKMSTRBJKCCGU-NNYUYHANSA-N
Mol Weight 270.32 g/mol
Molecular Formula C14H22O5
Exact Mass 270.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8C6XcO4WFwW
Name (1R,2S,6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxy-1-cyclohex-3-enecarboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O5
InChI InChI=1S/C14H22O5/c1-4-17-13(16)12-9(6-5-7-10(12)15)11-8-18-14(2,3)19-11/h5,7,9-12,15H,4,6,8H2,1-3H3/t9-,10-,11+,12+/m0/s1
InChIKey UWKMSTRBJKCCGU-NNYUYHANSA-N
Molecular Weight 270.325 g/mol
SMILES O[C@@]1([C@@]([C@]([C@@]2(OC(C)(C)OC2)[H])(CC=C1)[H])(C(=O)OCC)[H])[H]
SPLASH splash10-0udj-0900000000-8a321afcf4cdf5f08493
Source of Spectrum QC-11-4504-14
Synonyms (1R,2S,6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxy-cyclohex-3-ene-1-carboxylic acid ethyl ester Ethyl (1R,2S,6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxy-cyclohex-3-ene-1-carboxylate Ethyl (1R,2S,6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-oxidanyl-cyclohex-3-ene-1-carboxylate
Wiley ID 860222