3-[3-(p-Methoxybenzyloxy)-2-methylpropenyl]hexahydrobenzo[e]-1,3]dioxepane

SpectraBase Compound ID	BFrsR3vq2TA
InChI	InChI=1S/C21H30O4/c1-16(12-23-13-17-7-9-20(22-2)10-8-17)11-21-24-14-18-5-3-4-6-19(18)15-25-21/h7-11,18-19,21H,3-6,12-15H2,1-2H3/t18-,19-/m1/s1
InChIKey	PYBJYUDVDWQIGK-RTBURBONSA-N Google Search
Mol Weight	346.47 g/mol
Molecular Formula	C21H30O4
Exact Mass	346.214409 g/mol

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SpectraBase Spectrum ID	DjS9IRopiYV
Name	3-[3-(p-Methoxybenzyloxy)-2-methylpropenyl]hexahydrobenzo[e]-1,3]dioxepane
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H30O4
InChI	InChI=1S/C21H30O4/c1-16(12-23-13-17-7-9-20(22-2)10-8-17)11-21-24-14-18-5-3-4-6-19(18)15-25-21/h7-11,18-19,21H,3-6,12-15H2,1-2H3/t18-,19-/m1/s1
InChIKey	PYBJYUDVDWQIGK-RTBURBONSA-N
Molecular Weight	346.467 g/mol
SMILES	C1(OC[C@]2(CCCC[C@@]2(CO1)[H])[H])C=C(COCc1ccc(cc1)OC)C
SPLASH	splash10-00dr-0910000000-ea010ad359e71ce4fe9e
Source of Spectrum	KC-60-424-17
Wiley ID	1583067