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3-Methoxy-2,4-dimethoxycarbonyl-5-(pentyl)phenol
SpectraBase Compound ID BfLbEZTq6vD
InChI InChI=1S/C16H22O6/c1-5-6-7-8-10-9-11(17)13(16(19)22-4)14(20-2)12(10)15(18)21-3/h9,17H,5-8H2,1-4H3
InChIKey YVZKWVNNOWBACW-UHFFFAOYSA-N
Mol Weight 310.35 g/mol
Molecular Formula C16H22O6
Exact Mass 310.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vIg5kp1uf7
Name 3-Methoxy-2,4-dimethoxycarbonyl-5-(pentyl)phenol
Alternate Name(s) Dimethyl 4-hydroxy-2-methoxy-6-pentylisophthalate
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Formula C16H22O6
InChI InChI=1S/C16H22O6/c1-5-6-7-8-10-9-11(17)13(16(19)22-4)14(20-2)12(10)15(18)21-3/h9,17H,5-8H2,1-4H3
InChIKey YVZKWVNNOWBACW-UHFFFAOYSA-N
Molecular Weight 310.346 g/mol
SMILES Oc1c(c(c(c(c1)CCCCC)C(=O)OC)OC)C(=O)OC
SPLASH splash10-00di-0091000000-969759ac127bb7a98a78
Source of Spectrum F4-0-2295-3
Wiley ID 1618569