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Succinic acid, cyclohexylmethyl hex-5-en-1-yl ester
SpectraBase Compound ID 9XugB0qaLYY
InChI InChI=1S/C17H28O4/c1-2-3-4-8-13-20-16(18)11-12-17(19)21-14-15-9-6-5-7-10-15/h2,15H,1,3-14H2
InChIKey JZMGDRAMNCYXIB-UHFFFAOYSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ugcpgYjyvg
Name Succinic acid, cyclohexylmethyl hex-5-en-1-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 296.198759378 u
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-2-3-4-8-13-20-16(18)11-12-17(19)21-14-15-9-6-5-7-10-15/h2,15H,1,3-14H2
InChIKey JZMGDRAMNCYXIB-UHFFFAOYSA-N
Molecular Weight 296.407 g/mol
SMILES C(CC(OCC1CCCCC1)=O)C(OCCCCC=C)=O