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2H-Cyclododeca[b]pyran-3-propanoic acid, 5,6,7,8,9,10,11,12,13,14-decahydro-.beta.,2-dioxo-, methyl ester
SpectraBase Compound ID EGhLUqkfF9s
InChI InChI=1S/C19H26O5/c1-23-18(21)13-16(20)15-12-14-10-8-6-4-2-3-5-7-9-11-17(14)24-19(15)22/h12H,2-11,13H2,1H3
InChIKey TYAGZIXAIBAWGS-UHFFFAOYSA-N
Mol Weight 334.41 g/mol
Molecular Formula C19H26O5
Exact Mass 334.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DL4EHc099F3
Name 2H-Cyclododeca[b]pyran-3-propanoic acid, 5,6,7,8,9,10,11,12,13,14-decahydro-.beta.,2-dioxo-, methyl ester
CAS Registry Number 62939-93-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O5
InChI InChI=1S/C19H26O5/c1-23-18(21)13-16(20)15-12-14-10-8-6-4-2-3-5-7-9-11-17(14)24-19(15)22/h12H,2-11,13H2,1H3
InChIKey TYAGZIXAIBAWGS-UHFFFAOYSA-N
Molecular Weight 334.412 g/mol
SMILES C=1(C(OC2=C(C1)CCCCCCCCCC2)=O)C(CC(=O)OC)=O
SPLASH splash10-0089-2059000000-75869a388886e46448f2
Source of Spectrum KC-1977-263-0
Synonyms Methyl 3-oxo-3-(2-oxo-5,6,7,8,9,10,11,12,13,14-decahydro-2H-cyclododeca[b]pyran-3-yl)propanoate Pyrone
Wiley ID 1330965