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Methyl 1-chloro-3-oxo-4-phenyl-1,3,4,4a,7,7a-hexahydrocyclopenta[c]pyran-1-carboxylate
SpectraBase Compound ID JH5noxXxTGP
InChI InChI=1S/C16H15ClO4/c1-20-15(19)16(17)12-9-5-8-11(12)13(14(18)21-16)10-6-3-2-4-7-10/h2-8,11-13H,9H2,1H3/t11?,12?,13-,16+/m1/s1
InChIKey BVSFYKUKZNVRKK-CULRUXPZSA-N
Mol Weight 306.75 g/mol
Molecular Formula C16H15ClO4
Exact Mass 306.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1ibdGB9CPM
Name Methyl 1-chloro-3-oxo-4-phenyl-1,3,4,4a,7,7a-hexahydrocyclopenta[c]pyran-1-carboxylate
Alternate Name(s) 1-Chloro-3-keto-4-phenyl-4,4a,7,7a-tetrahydrocyclopenta[c]pyran-1-carboxylic acid methyl ester 1-Chloro-3-oxo-4-phenyl-4,4a,7,7a-tetrahydrocyclopenta[c]pyran-1-carboxylic acid methyl ester Cyclopenta[c]pyran-1-carboxylic acid, 1-chloro-1,3,4,4a,7,7a-hexahydro-3-oxo-4-phenyl-, methyl ester, (4.alpha.,4a.beta.,7a.beta.)- Methyl 1-chloranyl-3-oxidanylidene-4-phenyl-4,4a,7,7a-tetrahydrocyclopenta[c]pyran-1-carboxylate Methyl 1-chloro-3-oxo-4-phenyl-4,4a,7,7a-tetrahydrocyclopenta[c]pyran-1-carboxylate
CAS Registry Number 140633-68-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClO4
InChI InChI=1S/C16H15ClO4/c1-20-15(19)16(17)12-9-5-8-11(12)13(14(18)21-16)10-6-3-2-4-7-10/h2-8,11-13H,9H2,1H3/t11?,12?,13-,16+/m1/s1
InChIKey BVSFYKUKZNVRKK-CULRUXPZSA-N
Molecular Weight 306.745 g/mol
SMILES [C@]1(OC([C@@](c2ccccc2)([C@@]2([C@]1(CC=C2)[H])[H])[H])=O)(C(=O)OC)Cl
SPLASH splash10-014l-5900000000-8460c998fe77556ee9b6
Source of Spectrum K-125-1916-9
Wiley ID 1307906