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[(1R,4R)-4-Acetoxy-1,2,2-trimethylcyclopentyl]methylketone
SpectraBase Compound ID 6AhNacGgVAE
InChI InChI=1S/C12H20O3/c1-8(13)12(5)7-10(15-9(2)14)6-11(12,3)4/h10H,6-7H2,1-5H3/t10-,12+/m1/s1
InChIKey WSBPWOXDDDHLLA-PWSUYJOCSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kkNq0OK5Qc
Name [(1R,4R)-4-Acetoxy-1,2,2-trimethylcyclopentyl]methylketone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-8(13)12(5)7-10(15-9(2)14)6-11(12,3)4/h10H,6-7H2,1-5H3/t10-,12+/m1/s1
InChIKey WSBPWOXDDDHLLA-PWSUYJOCSA-N
Literature Reference DOI 10.1002/hlca.19830660706
Molecular Weight 212.289 g/mol
SMILES C(=O)(C)[C@]1(C(C[C@](C1)(OC(=O)C)[H])(C)C)C
SPLASH splash10-0a4i-5900000000-443a001b358fb3a65c7e
Source of Spectrum H-66-1952-17b
Synonyms Acetic acid-[(1R,3R)-3-acetyl-3,4,4-trimethylcyclopentyl]ester (1R,3R)-3-acetyl-3,4,4-trimethylcyclopentyl acetate
Wiley ID 1797614