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3-[4-(2,3-dihydroxyphenyl)butyl]benzene-1,2-diol
SpectraBase Compound ID DiCdaMb5Cez
InChI InChI=1S/C16H18O4/c17-13-9-3-7-11(15(13)19)5-1-2-6-12-8-4-10-14(18)16(12)20/h3-4,7-10,17-20H,1-2,5-6H2
InChIKey CVTRVDLXKBSRMN-UHFFFAOYSA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EopweCBqrUR
Name 3-[4-(2,3-dihydroxyphenyl)butyl]benzene-1,2-diol
Alternate Name(s) 3-[4-(2,3-Dihydroxyphenyl)butyl]pyrocatechol 3-[4-[2,3-bis(oxidanyl)phenyl]butyl]benzene-1,2-diol
Comments Less than 3 mono-isotopic peaks
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Formula C16H18O4
InChI InChI=1S/C16H18O4/c17-13-9-3-7-11(15(13)19)5-1-2-6-12-8-4-10-14(18)16(12)20/h3-4,7-10,17-20H,1-2,5-6H2
InChIKey CVTRVDLXKBSRMN-UHFFFAOYSA-N
Molecular Weight 274.316 g/mol
SMILES Oc1c(c(CCCCc2c(c(ccc2)O)O)ccc1)O
SPLASH splash10-00di-0790000000-19906901c749e5df1a02
Source of Spectrum SO-0-234-3
Wiley ID 873415