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Cyclopentane-3,3-d2-carboxylic acid, 5,5-dimethyl-, methyl ester
SpectraBase Compound ID AoVRbZESVjj
InChI InChI=1S/C9H16O2/c1-9(2)6-4-5-7(9)8(10)11-3/h7H,4-6H2,1-3H3/i4D2
InChIKey BRYZWBAMNWWEGG-APZFVMQVSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H14D2O2
Exact Mass 158.127583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxmXfdvjrZY
Name Cyclopentane-3,3-d2-carboxylic acid, 5,5-dimethyl-, methyl ester
CAS Registry Number 79640-16-7
Comments Less than 3 mono-isotopic peaks
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Formula C9H14D2O2
InChI InChI=1S/C9H16O2/c1-9(2)6-4-5-7(9)8(10)11-3/h7H,4-6H2,1-3H3/i4D2
InChIKey BRYZWBAMNWWEGG-APZFVMQVSA-N
Molecular Weight 158.237 g/mol
SMILES C(C1C(CC(C1)([D])[D])(C)C)(=O)OC
SPLASH splash10-0a4i-0900000000-91976afa49f60f57015c
Source of Spectrum I-59-2108-0
Synonyms Methyl 3,3-dideuterio-5,5-dimethylcyclopentanecarboxylate
Wiley ID 1153930