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dimethyl (3R*,4S*)-3-acetyl-4-[(methoxycarbonyl)methyl]-3-methyl-1,1-cyclopentanedicarboxylate
SpectraBase Compound ID 8LxTPioqOkF
InChI InChI=1S/C15H22O7/c1-9(16)14(2)8-15(12(18)21-4,13(19)22-5)7-10(14)6-11(17)20-3/h10H,6-8H2,1-5H3/t10-,14+/m1/s1
InChIKey AIIXVCYDDUJJBR-YGRLFVJLSA-N
Mol Weight 314.33 g/mol
Molecular Formula C15H22O7
Exact Mass 314.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1lM8nAGZYk
Name dimethyl (3R*,4S*)-3-acetyl-4-[(methoxycarbonyl)methyl]-3-methyl-1,1-cyclopentanedicarboxylate
Alternate Name(s) dimethyl (3R,4S)-3-acetyl-4-(2-methoxy-2-oxoethyl)-3-methyl-1,1-cyclopentanedicarboxylate
CAS Registry Number 106192-24-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O7
InChI InChI=1S/C15H22O7/c1-9(16)14(2)8-15(12(18)21-4,13(19)22-5)7-10(14)6-11(17)20-3/h10H,6-8H2,1-5H3/t10-,14+/m1/s1
InChIKey AIIXVCYDDUJJBR-YGRLFVJLSA-N
Molecular Weight 314.334 g/mol
SMILES C1(C[C@](C(=O)C)(C)[C@@](C1)(CC(=O)OC)[H])(C(=O)OC)C(=O)OC
SPLASH splash10-0006-9000000000-4d6eeda82ca20fbe0453
Source of Spectrum J-52-466-9
Wiley ID 1314828