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Ethyl-(1R,2R,3S,4R,5R)-6-Oxotricyclo[3.2.1.0(2.4)]octane-3-carboxylate
SpectraBase Compound ID A7Nh6yOMBud
InChI InChI=1S/C11H14O3/c1-2-14-11(13)10-8-5-3-6(9(8)10)7(12)4-5/h5-6,8-10H,2-4H2,1H3/t5-,6+,8-,9+,10+/m1/s1
InChIKey SHNWLIQUNQXBMP-JSKNTUGKSA-N
Mol Weight 194.23 g/mol
Molecular Formula C11H14O3
Exact Mass 194.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTr1lshizRs
Name Ethyl-(1R,2R,3S,4R,5R)-6-Oxotricyclo[3.2.1.0(2.4)]octane-3-carboxylate
Alternate Name(s) Ethyl (1R,2R,3S,4R,5R)-6-oxotricyclo[3.2.1.0(2,4)]octane-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O3
InChI InChI=1S/C11H14O3/c1-2-14-11(13)10-8-5-3-6(9(8)10)7(12)4-5/h5-6,8-10H,2-4H2,1H3/t5-,6+,8-,9+,10+/m1/s1
InChIKey SHNWLIQUNQXBMP-JSKNTUGKSA-N
Literature Reference DOI 10.1002/hlca.200490202
Molecular Weight 194.230 g/mol
SMILES [C@]12([C@]3([C@@]([C@](C2)(CC1=O)[H])([C@@]3(C(OCC)=O)[H])[H])[H])[H]
SPLASH splash10-004i-9300000000-6eb8fb7de48ca79725e8
Source of Spectrum H-87-2254-anti_11
Wiley ID 1785597