(2R / 2S)-4,5-Benzo-3,6-[(endo)-3'-oxoprop-1'-ene-1',3'-diyl]-2-ethoxycyclohexane

SpectraBase Compound ID	Bh0er3gSjBg
InChI	InChI=1S/C15H16O2/c1-2-17-15-9-13-11-6-4-3-5-10(11)12(15)7-8-14(13)16/h3-8,12-13,15H,2,9H2,1H3/t12-,13-,15+/m0/s1
InChIKey	FGAFJPGIHDQLAB-UHFFFAOYSA-N Google Search
Mol Weight	228.29 g/mol
Molecular Formula	C15H16O2
Exact Mass	228.11503 g/mol

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SpectraBase Spectrum ID	EVP8dPCEivV
Name	(2R / 2S)-4,5-Benzo-3,6-[(endo)-3'-oxoprop-1'-ene-1',3'-diyl]-2-ethoxycyclohexane
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H16O2
InChI	InChI=1S/C15H16O2/c1-2-17-15-9-13-11-6-4-3-5-10(11)12(15)7-8-14(13)16/h3-8,12-13,15H,2,9H2,1H3/t12-,13-,15?/m0/s1
InChIKey	FGAFJPGIHDQLAB-UHFFFAOYSA-N
Molecular Weight	228.291 g/mol
SMILES	[C@]12(c3c(cccc3)[C@@](C(C1)OCC)(C=CC2=O)[H])[H]
SPLASH	splash10-004i-0950000000-ff30fc135da7f3b3d0f5
Source of Spectrum	C-121-4597-13
Synonyms	(2S / 2R)-4,5-Benzo-3,6-[(endo)-3'-oxoprop-1'-ene-1',3'-diyl]-2-ethoxycyclohexane
Wiley ID	1700203