dimethyl (1R*,5S*,8S*)-(+-)-8-(hydroxymethyl)tricyclo[6.2.1.0(1,5)]undec-9-ene-9,10-dicarboxylate

SpectraBase Compound ID	4GvEf4s7J07
InChI	InChI=1S/C16H22O5/c1-20-13(18)11-12(14(19)21-2)16-6-3-4-10(16)5-7-15(11,8-16)9-17/h10,17H,3-9H2,1-2H3/t10-,15+,16+/m0/s1
InChIKey	LYQBBIWHBHGGFN-AMKSKSKJSA-N Google Search
Mol Weight	294.35 g/mol
Molecular Formula	C16H22O5
Exact Mass	294.146724 g/mol

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SpectraBase Spectrum ID	BBK8CaJAfN
Name	dimethyl (1R,5S,8S*)-(+-)-8-(hydroxymethyl)tricyclo[6.2.1.0(1,5)]undec-9-ene-9,10-dicarboxylate
CAS Registry Number	120966-92-9
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H22O5
InChI	InChI=1S/C16H22O5/c1-20-13(18)11-12(14(19)21-2)16-6-3-4-10(16)5-7-15(11,8-16)9-17/h10,17H,3-9H2,1-2H3/t10-,15+,16+/m0/s1
InChIKey	LYQBBIWHBHGGFN-AMKSKSKJSA-N
Molecular Weight	294.347 g/mol
SMILES	OC[C@@]12C(=C([C@]3(C2)[C@](CC1)(CCC3)[H])C(=O)OC)C(=O)OC
SPLASH	splash10-001i-0090000000-a67cd2d7220132fa302f
Source of Spectrum	K-122-1972-1
Synonyms	dimethyl (1R,5S,8S)-8-(hydroxymethyl)tricyclo[6.2.1.0(1,5)]undec-9-ene-9,10-dicarboxylate
Wiley ID	1297142