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Syn-2-(Tetrahydro-2-furanyl) butanedioic acid 1,4-dibutyl ester
SpectraBase Compound ID 5c1yGbMg2ww
InChI InChI=1S/C16H28O5/c1-3-5-9-20-15(17)12-13(14-8-7-11-19-14)16(18)21-10-6-4-2/h13-14H,3-12H2,1-2H3/t13-,14-/m0/s1
InChIKey CCHZVUMEIOEHIR-KBPBESRZSA-N
Mol Weight 300.4 g/mol
Molecular Formula C16H28O5
Exact Mass 300.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ItV3v0ZfGjO
Name Syn-2-(Tetrahydro-2-furanyl) butanedioic acid 1,4-dibutyl ester
Appearance Colorless oil
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Formula C16H28O5
InChI InChI=1S/C16H28O5/c1-3-5-9-20-15(17)12-13(14-8-7-11-19-14)16(18)21-10-6-4-2/h13-14H,3-12H2,1-2H3/t13-,14-/m0/s1
InChIKey CCHZVUMEIOEHIR-KBPBESRZSA-N
Instrument Name Shimadzu GCMS-QP2010 plus
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p011.509
Molecular Weight 300.395 g/mol
Reported Formula C16H28O5
SMILES C1O[C@@](CC1)([C@@](C(=O)OCCCC)(CC(OCCCC)=O)[H])[H]
SPLASH splash10-00dl-9000000000-3f3679d4b54d7ab90ca9
Source of Spectrum ARK-2021-151-3b-syn
Wiley ID 1873140