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4a(2H)-Naphthalenecarboxylic acid, 1,3,4,5,6,7-hexahydro-7-hydroxy-, methyl ester, cis-
SpectraBase Compound ID 8PzHad1dK73
InChI InChI=1S/C12H18O3/c1-15-11(14)12-6-3-2-4-9(12)8-10(13)5-7-12/h4,10,13H,2-3,5-8H2,1H3/t10-,12+/m1/s1
InChIKey XRKQAVMIOCTWBE-PWSUYJOCSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EKpfay0z9y6
Name 4a(2H)-Naphthalenecarboxylic acid, 1,3,4,5,6,7-hexahydro-7-hydroxy-, methyl ester, cis-
CAS Registry Number 99748-14-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-15-11(14)12-6-3-2-4-9(12)8-10(13)5-7-12/h4,10,13H,2-3,5-8H2,1H3/t10-,12+/m1/s1
InChIKey XRKQAVMIOCTWBE-PWSUYJOCSA-N
Molecular Weight 210.273 g/mol
SMILES O[C@@]1(CC[C@@]2(C(C1)=CCCC2)C(=O)OC)[H]
SPLASH splash10-000x-5900000000-6003d9f2dcb893637988
Source of Spectrum J-51-804-4
Synonyms (2.alpha.,4a.alpha.)-octahydro-4a-(methoxycarbonyl)naphthalen-2-ol Methyl (2R,4aS)-2-hydroxy-1,3,4,5,6,7-hexahydro-4a(2H)-naphthalenecarboxylate
Wiley ID 1209241