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2,5-Cyclohexadiene-1-carboxylic acid, 1-[(phenylmethoxy)methyl]-, methyl ester
SpectraBase Compound ID 2QwarOUCQCh
InChI InChI=1S/C16H18O3/c1-18-15(17)16(10-6-3-7-11-16)13-19-12-14-8-4-2-5-9-14/h2,4-11H,3,12-13H2,1H3
InChIKey NWLGLBGXPHOQKL-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0nNa7L7BJT
Name 2,5-Cyclohexadiene-1-carboxylic acid, 1-[(phenylmethoxy)methyl]-, methyl ester
CAS Registry Number 74269-64-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-18-15(17)16(10-6-3-7-11-16)13-19-12-14-8-4-2-5-9-14/h2,4-11H,3,12-13H2,1H3
InChIKey NWLGLBGXPHOQKL-UHFFFAOYSA-N
Molecular Weight 258.317 g/mol
SMILES C1(C(=O)OC)(C=CCC=C1)COCc1ccccc1
SPLASH splash10-0006-9400000000-d9ec5cb47c516552ac06
Source of Spectrum F-35-2394-0
Synonyms 1-Benzyloxymethyl-1-methoxycarbonyl-2,5-cyclohexadiene Methyl 1-[(benzyloxy)methyl]-2,5-cyclohexadiene-1-carboxylate
Wiley ID 1262014