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1,4-Dimethyl-4-[4-(hydroxymethyl)-3,4-epoxypentyl]-5,5-(ethylenedioxy)cycloheptene isomer
SpectraBase Compound ID EGO5nqITD76
InChI InChI=1S/C17H28O4/c1-13-4-7-15(2,8-6-14-16(3,12-18)21-14)17(9-5-13)19-10-11-20-17/h4,14,18H,5-12H2,1-3H3/t14?,15-,16?/m0/s1
InChIKey WELUGYFRHPCHCE-PCKAHOCUSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4daGVLiLZ1T
Name 1,4-Dimethyl-4-[4-(hydroxymethyl)-3,4-epoxypentyl]-5,5-(ethylenedioxy)cycloheptene isomer
Alternate Name(s) {3-[2-((R)-6,9-Dimethyl-1,4-dioxa-spiro[4.6]undec-8-en-6-yl)-ethyl]-2-methyl-oxiranyl}-methanol [3-[2-[(6R)-6,9-dimethyl-1,4-dioxaspiro[4.6]undec-8-en-6-yl]ethyl]-2-methyl-2-oxiranyl]methanol [3-[2-[(6R)-6,9-dimethyl-1,4-dioxaspiro[4.6]undec-8-en-6-yl]ethyl]-2-methyloxiran-2-yl]methanol
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Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-13-4-7-15(2,8-6-14-16(3,12-18)21-14)17(9-5-13)19-10-11-20-17/h4,14,18H,5-12H2,1-3H3/t14?,15-,16?/m0/s1
InChIKey WELUGYFRHPCHCE-PCKAHOCUSA-N
Molecular Weight 296.407 g/mol
SMILES OCC1(OC1CC[C@]1(C2(OCCO2)CCC(=CC1)C)C)C
SPLASH splash10-000i-9720000000-5970d897ef2469ccf580
Source of Spectrum F-50-12666-17
Wiley ID 789966