SpectraBase Spectrum ID |
Hp1HjGzc4ap |
Name |
ethyl (1R*,2S*,4S*)-(+-)-1,2,3,4,5,6,7,8,9,10-decahydro-1,4-epoxybenzocyclooctene-2-carboxylate |
CAS Registry Number |
114379-53-2 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H22O3 |
InChI |
InChI=1S/C15H22O3/c1-2-17-15(16)12-9-13-10-7-5-3-4-6-8-11(10)14(12)18-13/h12-14H,2-9H2,1H3/t12-,13-,14-/m0/s1 |
InChIKey |
NPVLYJKDCPZGFB-IHRRRGAJSA-N |
Molecular Weight |
250.338 g/mol |
SMILES |
[C@]12([C@](C[C@@](O2)([H])C2=C1CCCCCC2)(C(=O)OCC)[H])[H] |
SPLASH |
splash10-0udi-0900000000-ef96239653a5ae350e15 |
Source of Spectrum |
K-121-1629-1 |
Synonyms |
ethyl (1S,10R,11S)-13-oxatricyclo[8.2.1.0(2,9)]tridec-2(9)-ene-11-carboxylate |
Wiley ID |
1253667 |