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Tricyclo[4.2.1.1(2,5)]deca-3,7-dien-9,10-diacetate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Tricyclo[4.2.1.1(2,5)]deca-3,7-dien-9,10-diacetate
SpectraBase Compound ID JOllR3BQa3n
InChI InChI=1S/C14H16O4/c1-7(15)17-13-9-3-4-10(13)12-6-5-11(9)14(12)18-8(2)16/h3-6,9-14H,1-2H3/t9-,10+,11+,12-,13-,14+
InChIKey VHRCPINPRXHWCV-UHFFFAOYSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1v64UDCwPti
Name Tricyclo[4.2.1.1(2,5)]deca-3,7-dien-9,10-diacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.104858991 u
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-7(15)17-13-9-3-4-10(13)12-6-5-11(9)14(12)18-8(2)16/h3-6,9-14H,1-2H3
InChIKey VHRCPINPRXHWCV-UHFFFAOYSA-N
Molecular Weight 248.278 g/mol
SMILES [C@]12(C=C[C@]([C@]2(OC(C)=O)[H])([C@]2(C=C[C@@]1([C@]2(OC(C)=O)[H])[H])[H])[H])[H]