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ethyl (1S,8S,11R,13S)-1,5,5-trimethyl-8-(2-methylprop-2-en-1-yl)-9-oxo-6-oxatricyclo[6.3.2.0(4,13)]tridecane-11-carboxylate

View entire compound with spectra: 1 MS (GC)

ethyl (1S,8S,11R,13S)-1,5,5-trimethyl-8-(2-methylprop-2-en-1-yl)-9-oxo-6-oxatricyclo[6.3.2.0(4,13)]tridecane-11-carboxylate
SpectraBase Compound ID ZgiHl8lD7j
InChI InChI=1S/C22H34O4/c1-7-25-19(24)16-10-18(23)22(11-14(2)3)13-26-20(4,5)15-8-9-21(16,6)12-17(15)22/h15-17H,2,7-13H2,1,3-6H3/t15?,16-,17-,21-,22+/m0/s1
InChIKey LTFPSVXUTAFRRL-FEHSRLQHSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uQvV5md96
Name ethyl (1S,8S,11R,13S)-1,5,5-trimethyl-8-(2-methylprop-2-en-1-yl)-9-oxo-6-oxatricyclo[6.3.2.0(4,13)]tridecane-11-carboxylate
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-7-25-19(24)16-10-18(23)22(11-14(2)3)13-26-20(4,5)15-8-9-21(16,6)12-17(15)22/h15-17H,2,7-13H2,1,3-6H3/t15?,16-,17-,21-,22+/m0/s1
InChIKey LTFPSVXUTAFRRL-FEHSRLQHSA-N
Instrument Name Shimadzu QP5050
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.4.34
Molecular Weight 362.510 g/mol
SMILES C1[C@]([C@@]2(C[C@@]3([C@](C1=O)(COC(C3CC2)(C)C)CC(=C)C)[H])C)(C(=O)OCC)[H]
SPLASH splash10-0a4l-9204000000-b25d9e2ba7e43397f1fa
Source of Spectrum BJO-4-SM3-24
Wiley ID 1871480