For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2H-Pyran-3-acetic acid, 2-(2,4-dichlorophenyl)tetrahydro-5,5-dimethyl-4,6-dioxo-, methyl ester
SpectraBase Compound ID LZGEtQ8JP1O
InChI InChI=1S/C16H16Cl2O5/c1-16(2)14(20)10(7-12(19)22-3)13(23-15(16)21)9-5-4-8(17)6-11(9)18/h4-6,10,13H,7H2,1-3H3
InChIKey XPQVSXVGVAMAKH-UHFFFAOYSA-N
Mol Weight 359.21 g/mol
Molecular Formula C16H16Cl2O5
Exact Mass 358.037479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7akWWtvBvmh
Name 2H-Pyran-3-acetic acid, 2-(2,4-dichlorophenyl)tetrahydro-5,5-dimethyl-4,6-dioxo-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16Cl2O5
InChI InChI=1S/C16H16Cl2O5/c1-16(2)14(20)10(7-12(19)22-3)13(23-15(16)21)9-5-4-8(17)6-11(9)18/h4-6,10,13H,7H2,1-3H3
InChIKey XPQVSXVGVAMAKH-UHFFFAOYSA-N
Molecular Weight 359.205 g/mol
SMILES c1(c(ccc(c1)Cl)C1C(C(C(C(O1)=O)(C)C)=O)CC(OC)=O)Cl
SPLASH splash10-0a4i-9410000000-c0c8e629a98fe2a5923d
Source of Spectrum IY-2-4710-8
Synonyms Methyl 2-[2-(2,4-dichlorophenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate 2-[2-(2,4-dichlorophenyl)-5,5-dimethyl-4,6-dioxo-3-oxanyl]acetic acid methyl ester Methyl 2-[2-(2,4-dichlorophenyl)-5,5-dimethyl-4,6-dioxo-tetrahydropyran-3-yl]acetate Methyl 2-[2-(2,4-dichlorophenyl)-5,5-dimethyl-4,6-bis(oxidanylidene)oxan-3-yl]ethanoate
Wiley ID 1655091