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Tricyclo[2.2.1.0(2,6)]heptane-3-carboxylic acid, 5-[[6-(1,1-dimethylethoxy)-6-oxohexyl]oxy]-, methyl ester, stereoisomer
SpectraBase Compound ID 7p4NYiOHdlk
InChI InChI=1S/C19H30O5/c1-19(2,3)24-15(20)8-6-5-7-11-23-17-14-10-9-13(12-14)16(17)18(21)22-4/h9-10,13-14,16-17H,5-8,11-12H2,1-4H3/t13-,14-,16?,17?/m1/s1
InChIKey AZRAKESYMSPQAQ-QBBMROGASA-N
Mol Weight 338.44 g/mol
Molecular Formula C19H30O5
Exact Mass 338.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwvmU6vfZoL
Name Tricyclo[2.2.1.0(2,6)]heptane-3-carboxylic acid, 5-[[6-(1,1-dimethylethoxy)-6-oxohexyl]oxy]-, methyl ester, stereoisomer
Alternate Name(s) 5endo-methoxycarbonyl-6exo-(5-(t-butoxycarbonyl)pentoxy)norbornene Methyl 3-[(6-tert-butoxy-6-oxohexyl)oxy]bicyclo[2.2.1]hept-5-ene-2-carboxylate
CAS Registry Number 90029-61-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30O5
InChI InChI=1S/C19H30O5/c1-19(2,3)24-15(20)8-6-5-7-11-23-17-14-10-9-13(12-14)16(17)18(21)22-4/h9-10,13-14,16-17H,5-8,11-12H2,1-4H3/t13-,14-,16?,17?/m1/s1
InChIKey AZRAKESYMSPQAQ-QBBMROGASA-N
Molecular Weight 338.444 g/mol
SMILES C1([C@@]2(C=C[C@@](C1OCCCCCC(OC(C)(C)C)=O)(C2)[H])[H])C(=O)OC
SPLASH splash10-014i-6920000000-0ab2bdb1e5cc7a2130af
Source of Spectrum J-49-2147-0
Wiley ID 1333779