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1,3-Cyclopentanedicarboxylic acid, 2-methyl-, dimethyl ester, (1.alpha.,2.alpha.,3.alpha.)-
SpectraBase Compound ID 99eb60Q0FEl
InChI InChI=1S/C10H16O4/c1-6-7(9(11)13-2)4-5-8(6)10(12)14-3/h6-8H,4-5H2,1-3H3/t6-,7-,8+
InChIKey VUTNENLJKPBEEF-WHUPJOBBSA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CH4gw2r70ij
Name 1,3-Cyclopentanedicarboxylic acid, 2-methyl-, dimethyl ester, (1.alpha.,2.alpha.,3.alpha.)-
CAS Registry Number 79692-92-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-6-7(9(11)13-2)4-5-8(6)10(12)14-3/h6-8H,4-5H2,1-3H3/t6-,7-,8+
InChIKey VUTNENLJKPBEEF-WHUPJOBBSA-N
Molecular Weight 200.234 g/mol
SMILES [C@@]1([C@]([C@](C(=O)OC)(CC1)[H])(C)[H])(C(=O)OC)[H]
SPLASH splash10-001l-6900000000-d83f48117a79793fbe00
Source of Spectrum I-59-2852-0
Synonyms Dimethyl (1R,3S)-2-methyl-1,3-cyclopentanedicarboxylate Dimethyl(1R,2S,3S)-2-methylcyclopentane-1,3-dicarboxylate
Wiley ID 1197401