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5-(Benzyloxy)-1,1-diethoxy-2-hydroxyundecan-4-one

View entire compound with spectra: 2 MS (GC)

5-(Benzyloxy)-1,1-diethoxy-2-hydroxyundecan-4-one
SpectraBase Compound ID K1rz3tu0iGG
InChI InChI=1S/C22H36O5/c1-4-7-8-12-15-21(27-17-18-13-10-9-11-14-18)19(23)16-20(24)22(25-5-2)26-6-3/h9-11,13-14,20-22,24H,4-8,12,15-17H2,1-3H3
InChIKey LBHHIGAAQAJJOA-UHFFFAOYSA-N
Mol Weight 380.5 g/mol
Molecular Formula C22H36O5
Exact Mass 380.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDBy3NBUmr
Name 5-(Benzyloxy)-1,1-diethoxy-2-hydroxyundecan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O5
InChI InChI=1S/C22H36O5/c1-4-7-8-12-15-21(27-17-18-13-10-9-11-14-18)19(23)16-20(24)22(25-5-2)26-6-3/h9-11,13-14,20-22,24H,4-8,12,15-17H2,1-3H3
InChIKey LBHHIGAAQAJJOA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200423
Molecular Weight 380.525 g/mol
SMILES OC(C(OCC)OCC)CC(C(CCCCCC)OCc1ccccc1)=O
SPLASH splash10-00b9-4940000000-1aa4674c27250af53f33
Source of Spectrum H-95-2120-16c_Bn_I
Wiley ID 1784218