endo-Tricyclo[5.2.1.02,6]decane-exo-2-carboxylic acid ethyl ester

CAS Registry Number®

80657-64-3

CAS Name

endo-Tricyclo[5.2.1.02,6]decane-exo-2-carboxylic acid ethyl ester

Molecular Formula

C13H20O2

Molecular Mass

208.30

Cite this Page

endo-Tricyclo[5.2.1.02,6]decane-exo-2-carboxylic acid ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80657-64-3 (retrieved 2024-12-03) (CAS RN: 80657-64-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C13H20O2/c1-2-15-12(14)13-7-3-4-11(13)9-5-6-10(13)8-9/h9-11H,2-8H2,1H3/t9-,10+,11-,13-/s2

InChIKey

InChIKey=MGQPKOBPXHENPO-AUWGJDPDNA-N

SMILES

C(OCC)(=O)[C@@]12[C@@]([C@]3(C[C@@]1(CC3)[H])[H])(CCC2)[H]

Canonical SMILES

O=C(OCC)C12CCCC2C3CCC1C3

Other Names for this Substance

  • 4,7-Methano-3aH-indene-3a-carboxylic acid, octahydro-, ethyl ester, (3aR,4S,7R,7aR)-rel-
  • 4,7-Methano-3aH-indene-3a-carboxylic acid, octahydro-, ethyl ester, (3aα,4α,7α,7aα)-
  • endo-Tricyclo[5.2.1.02,6]decane-exo-2-carboxylic acid ethyl ester

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