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2-Cyclopenten-1-one, 4-[(1,1-dimethylethoxy)methyl]-4-(2-propynyloxy)-, (R)-
SpectraBase Compound ID 1KXq2PNl5eL
InChI InChI=1S/C13H18O3/c1-5-8-15-13(7-6-11(14)9-13)10-16-12(2,3)4/h1,6-7H,8-10H2,2-4H3/t13-/m0/s1
InChIKey OUZFPQPOWWRFJI-ZDUSSCGKSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tCt706wPFu
Name 2-Cyclopenten-1-one, 4-[(1,1-dimethylethoxy)methyl]-4-(2-propynyloxy)-, (R)-
Alternate Name(s) (4R)-4-(tert-butoxymethyl)-4-(2-propynyloxy)-2-cyclopenten-1-one (4R-4-(tert-butoxymethyl)-4-(2-propynyloxy)-2-cyclopentenone
CAS Registry Number 126375-20-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-5-8-15-13(7-6-11(14)9-13)10-16-12(2,3)4/h1,6-7H,8-10H2,2-4H3/t13-/m0/s1
InChIKey OUZFPQPOWWRFJI-ZDUSSCGKSA-N
Molecular Weight 222.284 g/mol
SMILES C(#C)CO[C@]1(C=CC(C1)=O)COC(C)(C)C
SPLASH splash10-000b-9800000000-79aaa94d3b84477c12e5
Source of Spectrum C-112-3503-13
Wiley ID 1222637