(2E,3Z,5E)-6-[(3S)-3-hydroxy-4,4-dimethyl-2,3-dihydro-1,5-benzodioxepin-7-yl]-2-(methoxymethylene)-3-methyl-hexa-3,5-dienoic acid methyl ester

SpectraBase Compound ID	2xLpfw1GSVG
InChI	InChI=1S/C21H26O6/c1-14(16(12-24-4)20(23)25-5)7-6-8-15-9-10-17-18(11-15)27-21(2,3)19(22)13-26-17/h6-12,19,22H,13H2,1-5H3/b8-6+,14-7-,16-12+/t19-/m0/s1
InChIKey	SMLIFVAKZCGFSF-MJAOIUGUSA-N Google Search
Mol Weight	374.43 g/mol
Molecular Formula	C21H26O6
Exact Mass	374.172939 g/mol

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SpectraBase Spectrum ID	D29a9elyGEu
Name	(2E,3Z,5E)-6-[(3S)-3-hydroxy-4,4-dimethyl-2,3-dihydro-1,5-benzodioxepin-7-yl]-2-(methoxymethylene)-3-methyl-hexa-3,5-dienoic acid methyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H26O6
InChI	InChI=1S/C21H26O6/c1-14(16(12-24-4)20(23)25-5)7-6-8-15-9-10-17-18(11-15)27-21(2,3)19(22)13-26-17/h6-12,19,22H,13H2,1-5H3/b8-6+,14-7-,16-12+/t19-/m0/s1
InChIKey	SMLIFVAKZCGFSF-MJAOIUGUSA-N
Molecular Weight	374.433 g/mol
SMILES	O[C@@]1(C(Oc2cc(\C=C\C=C/(\C(C(=O)OC)=C/OC)C)ccc2OC1)(C)C)[H]
SPLASH	splash10-009i-1279000000-b00a6902fe3125adc2d2
Source of Spectrum	F-55-10111-1
Synonyms	(2E,3Z,5E)-6-[(3S)-3-hydroxy-4,4-dimethyl-2,3-dihydro-1,5-benzodioxepin-7-yl]-2-(methoxymethylidene)-3-methylhexa-3,5-dienoic acid methyl ester Methyl (2E,3Z,5E)-6-[(3S)-3-hydroxy-4,4-dimethyl-2,3-dihydro-1,5-benzodioxepin-7-yl]-2-(methoxymethylene)-3-methyl-hexa-3,5-dienoate Methyl (2E,3Z,5E)-6-[(3S)-3-hydroxy-4,4-dimethyl-2,3-dihydro-1,5-benzodioxepin-7-yl]-2-(methoxymethylidene)-3-methylhexa-3,5-dienoate Methyl (2E,3Z,5E)-6-[(3S)-4,4-dimethyl-3-oxidanyl-2,3-dihydro-1,5-benzodioxepin-7-yl]-2-(methoxymethylidene)-3-methyl-hexa-3,5-dienoate
Wiley ID	838906