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1,3-Cyclopentanedicarboxylic acid, 4-(acetyloxy)-2-(1-bromo-2-hydroxy-3-methoxy-3-oxopropyl)-, dimethyl ester
SpectraBase Compound ID 16zrceNX4yN
InChI InChI=1S/C15H21BrO9/c1-6(17)25-8-5-7(13(19)22-2)9(10(8)14(20)23-3)11(16)12(18)15(21)24-4/h7-12,18H,5H2,1-4H3
InChIKey VBMUTEIBIBGITP-UHFFFAOYSA-N
Mol Weight 425.23 g/mol
Molecular Formula C15H21BrO9
Exact Mass 424.036895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5eL0huWWE81
Name 1,3-Cyclopentanedicarboxylic acid, 4-(acetyloxy)-2-(1-bromo-2-hydroxy-3-methoxy-3-oxopropyl)-, dimethyl ester
Alternate Name(s) Dimethyl 1-acetoxy-3-[2-(methoxycarbonyl)-2-hydroxy-1-bromoethyl]cyclopentane-2,4-dicarboxylate Dimethyl 4-(acetyloxy)-2-(1-bromo-2-hydroxy-3-methoxy-3-oxopropyl)-1,3-cyclopentanedicarboxylate
CAS Registry Number 123993-48-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21BrO9
InChI InChI=1S/C15H21BrO9/c1-6(17)25-8-5-7(13(19)22-2)9(10(8)14(20)23-3)11(16)12(18)15(21)24-4/h7-12,18H,5H2,1-4H3
InChIKey VBMUTEIBIBGITP-UHFFFAOYSA-N
Molecular Weight 425.228 g/mol
SMILES OC(C(C1C(C(OC(=O)C)CC1C(=O)OC)C(=O)OC)Br)C(=O)OC
SPLASH splash10-0006-9312000000-67f9b615508ddc0ed38c
Source of Spectrum J-55-110-26
Wiley ID 1379064