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1,4-Ethanonaphthalene-6-carboxylic acid, 1,2,3,4,5,8-hexahydro-3-hydroxy-, methyl ester, (1.alpha.,3.alpha.,4.alpha.)-
SpectraBase Compound ID 79lGJRPh3Xa
InChI InChI=1S/C14H18O3/c1-17-14(16)9-3-4-10-8-2-5-11(12(10)6-9)13(15)7-8/h3,8,11,13,15H,2,4-7H2,1H3/t8-,11-,13-/m1/s1
InChIKey KPKQWQGYEQOBKJ-XTWCZFFVSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5l9OyqMONh
Name 1,4-Ethanonaphthalene-6-carboxylic acid, 1,2,3,4,5,8-hexahydro-3-hydroxy-, methyl ester, (1.alpha.,3.alpha.,4.alpha.)-
CAS Registry Number 82978-56-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-17-14(16)9-3-4-10-8-2-5-11(12(10)6-9)13(15)7-8/h3,8,11,13,15H,2,4-7H2,1H3/t8-,11-,13-/m1/s1
InChIKey KPKQWQGYEQOBKJ-XTWCZFFVSA-N
Molecular Weight 234.295 g/mol
SMILES O[C@]1([C@]2(C3=C([C@]([H])(CC2)C1)CC=C(C3)C(=O)OC)[H])[H]
SPLASH splash10-003u-0900000000-1d12efa0b208673edfff
Source of Spectrum H-65-200-0
Synonyms Methyl (1R,8R,10R)-10-hydroxytricyclo[6.2.2.0(2,7)]dodeca-2(7),4-diene-4-carboxylate Methyl 9exo- and 10exo-hydroxytricyclo[6.2.2.0(2,7)]dodeca-2(7),4-diene-4-carboxylate
Wiley ID 1236110