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tert-Butyl 2-(((R,E)-1-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-3-(((1S,5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-yl)oxy)allyl)oxy)acetate

View entire compound with spectra: 1 MS (GC)

tert-Butyl 2-(((R,E)-1-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-3-(((1S,5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-yl)oxy)allyl)oxy)acetate
SpectraBase Compound ID FG3rItQ9nOB
InChI InChI=1S/C24H38O6/c1-16(2)18-10-9-17(3)20(13-18)26-12-11-19(21-14-28-24(7,8)29-21)27-15-22(25)30-23(4,5)6/h9,11-12,18-21H,1,10,13-15H2,2-8H3/b12-11+/t18-,19+,20-,21+/m0/s1
InChIKey NTOZEZANURFWDX-QMTHTROLSA-N
Mol Weight 422.6 g/mol
Molecular Formula C24H38O6
Exact Mass 422.266839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID INjLniCvdFP
Name tert-Butyl 2-(((R,E)-1-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-3-(((1S,5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-yl)oxy)allyl)oxy)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O6
InChI InChI=1S/C24H38O6/c1-16(2)18-10-9-17(3)20(13-18)26-12-11-19(21-14-28-24(7,8)29-21)27-15-22(25)30-23(4,5)6/h9,11-12,18-21H,1,10,13-15H2,2-8H3/b12-11+/t18-,19+,20-,21+/m0/s1
InChIKey NTOZEZANURFWDX-QMTHTROLSA-N
Literature Reference DOI 10.1021/ol702231j
Molecular Weight 422.562 g/mol
SMILES C(C)(OC(CO[C@](\C=C\O[C@]1(C[C@](CC=C1C)(C(C)=C)[H])[H])([C@]1(COC(C)(C)O1)[H])[H])=O)(C)C
SPLASH splash10-0a4i-9001000000-5b0b81c7d1a9981ebeeb
Source of Spectrum A1-9-5373/SMSI11-13d
Wiley ID 1758782