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2-Allyl-6-methoxy-benzoic acid (1S,2S,3S)-1-[2-(4-methoxy-benzyloxy)-ethyl]-2-methoxymethoxy-3,6-dimethyl-hept-5-enyl ester

View entire compound with spectra: 1 MS (GC)

2-Allyl-6-methoxy-benzoic acid (1S,2S,3S)-1-[2-(4-methoxy-benzyloxy)-ethyl]-2-methoxymethoxy-3,6-dimethyl-hept-5-enyl ester
SpectraBase Compound ID FLlKei2Tieu
InChI InChI=1S/C32H44O7/c1-8-10-26-11-9-12-28(36-7)30(26)32(33)39-29(31(38-22-34-5)24(4)14-13-23(2)3)19-20-37-21-25-15-17-27(35-6)18-16-25/h8-9,11-13,15-18,24,29,31H,1,10,14,19-22H2,2-7H3/t24-,29-,31-/m0/s1
InChIKey HGMOBKFXHOZLSY-PPSCSQRBSA-N
Mol Weight 540.7 g/mol
Molecular Formula C32H44O7
Exact Mass 540.308704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 86cl83NQOgr
Name 2-Allyl-6-methoxy-benzoic acid (1S,2S,3S)-1-[2-(4-methoxy-benzyloxy)-ethyl]-2-methoxymethoxy-3,6-dimethyl-hept-5-enyl ester
Alternate Name(s) (1S,2S,3S)-1-{2-[(4-methoxybenzyl)oxy]ethyl}-2-(methoxymethoxy)-3,6-dimethyl-5-heptenyl 2-allyl-6-methoxybenzoate 2-Allyl-6-methoxybenzoic acid (1S,3R,4S)-1-[2-(4-Methoxybenzyl)ethyl]-3-methoxymethyl-4,7-dimethyloct-6-enyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H44O7
InChI InChI=1S/C32H44O7/c1-8-10-26-11-9-12-28(36-7)30(26)32(33)39-29(31(38-22-34-5)24(4)14-13-23(2)3)19-20-37-21-25-15-17-27(35-6)18-16-25/h8-9,11-13,15-18,24,29,31H,1,10,14,19-22H2,2-7H3/t24-,29-,31-/m0/s1
InChIKey HGMOBKFXHOZLSY-PPSCSQRBSA-N
Molecular Weight 540.697 g/mol
SMILES C(c1c(OC)cccc1CC=C)(O[C@]([C@]([C@](CC=C(C)C)(C)[H])(OCOC)[H])(CCOCc1ccc(cc1)OC)[H])=O
SPLASH splash10-00di-1900000000-e17ef1ce8e4d0c5f47aa
Source of Spectrum QE-7-5294-36
Wiley ID 846169