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Glutaric acid, myrtenyl 2-methylpent-3-yl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Glutaric acid, myrtenyl 2-methylpent-3-yl ester
SpectraBase Compound ID 8Lu6REMBsYl
InChI InChI=1S/C21H34O4/c1-6-18(14(2)3)25-20(23)9-7-8-19(22)24-13-15-10-11-16-12-17(15)21(16,4)5/h10,14,16-18H,6-9,11-13H2,1-5H3
InChIKey QBQDMMHIMWCVRZ-UHFFFAOYSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9bsHptetd8U
Name Glutaric acid, myrtenyl 2-methylpent-3-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 350.245709571 u
Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-6-18(14(2)3)25-20(23)9-7-8-19(22)24-13-15-10-11-16-12-17(15)21(16,4)5/h10,14,16-18H,6-9,11-13H2,1-5H3
InChIKey QBQDMMHIMWCVRZ-UHFFFAOYSA-N
Molecular Weight 350.499 g/mol
SMILES C(CCC(OC(CC)C(C)C)=O)C(OCC=1C2C(C(CC1)C2)(C)C)=O