2-Buten-1-one, 1-(1,4-dihydroxy-2,6,6-trimethyl-2-cyclohexen-1-yl)-, [1.alpha.(E),4.alpha.]-

SpectraBase Compound ID	6v8CNrNkIFW
InChI	InChI=1S/C13H20O3/c1-5-6-11(15)13(16)9(2)7-10(14)8-12(13,3)4/h5-7,10,14,16H,8H2,1-4H3/b6-5+/t10-,13+/m0/s1
InChIKey	AOWYHKJLMKALDS-ZOLRFCATSA-N Google Search
Mol Weight	224.3 g/mol
Molecular Formula	C13H20O3
Exact Mass	224.141245 g/mol

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SpectraBase Spectrum ID	3iNf7tE8CO
Name	2-Buten-1-one, 1-(1,4-dihydroxy-2,6,6-trimethyl-2-cyclohexen-1-yl)-, [1.alpha.(E),4.alpha.]-
Alternate Name(s)	(2E)-1-[(1R,4R)-1,4-dihydroxy-2,6,6-trimethyl-2-cyclohexen-1-yl]-2-buten-1-one 3,6-Dihydroxy-.alpha.-damascone
CAS Registry Number	54345-34-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H20O3
InChI	InChI=1S/C13H20O3/c1-5-6-11(15)13(16)9(2)7-10(14)8-12(13,3)4/h5-7,10,14,16H,8H2,1-4H3/b6-5+/t10-,13+/m0/s1
InChIKey	AOWYHKJLMKALDS-ZOLRFCATSA-N
Molecular Weight	224.300 g/mol
SMILES	O[C@]1(C=C([C@](C(C1)(C)C)(C(\C=C\C)=O)O)C)[H]
SPLASH	splash10-0a4l-9600000000-464d84cadff2aaf345b3
Source of Spectrum	H-54-2032-5
Wiley ID	1225228