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Adamantane-1-acetic acid methyl ester
SpectraBase Compound ID DTzxxeGHu27
InChI InChI=1S/C13H20O2/c1-15-12(14)8-13-5-9-2-10(6-13)4-11(3-9)7-13/h9-11H,2-8H2,1H3/t9-,10+,11-,13-
InChIKey MZIVXJGBKLZCKF-DNSLJTBWSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZ8s0ySSOmM
Name Adamantane-1-acetic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-15-12(14)8-13-5-9-2-10(6-13)4-11(3-9)7-13/h9-11H,2-8H2,1H3/t9-,10+,11-,13-
InChIKey MZIVXJGBKLZCKF-DNSLJTBWSA-N
Literature Reference DOI 10.1002/rcm.6996
Molecular Weight 208.301 g/mol
SMILES C1C2(C[C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])CC(=O)OC
SPLASH splash10-000l-9400000000-f543fe8087a1e7914522
Source of Spectrum RCM-28-SM4-FigS4(B)
Synonyms Methyl 2-((3r,5r,7r)-adamantan-1-yl)acetate
Wiley ID 1820750