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2-[(3aR,4R,6S,6aS)-4-hydroxy-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]acetic acid tert-butyl ester

View entire compound with spectra: 1 MS (GC)

2-[(3aR,4R,6S,6aS)-4-hydroxy-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]acetic acid tert-butyl ester
SpectraBase Compound ID 3an0YM8L582
InChI InChI=1S/C14H24O5/c1-13(2,3)17-10(16)7-8-6-9(15)12-11(8)18-14(4,5)19-12/h8-9,11-12,15H,6-7H2,1-5H3/t8-,9+,11-,12+/m0/s1
InChIKey NBQPWHCHNFTINJ-BSJXLVFVSA-N
Mol Weight 272.34 g/mol
Molecular Formula C14H24O5
Exact Mass 272.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eq4pwHXw8J1
Name 2-[(3aR,4R,6S,6aS)-4-hydroxy-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]acetic acid tert-butyl ester
Alternate Name(s) tert-butyl 2-[(3aR,4R,6S,6aS)-2,2-dimethyl-4-oxidanyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]ethanoate tert-butyl 2-[(3aR,4R,6S,6aS)-4-hydroxy-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]acetate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O5
InChI InChI=1S/C14H24O5/c1-13(2,3)17-10(16)7-8-6-9(15)12-11(8)18-14(4,5)19-12/h8-9,11-12,15H,6-7H2,1-5H3/t8-,9+,11-,12+/m0/s1
InChIKey NBQPWHCHNFTINJ-BSJXLVFVSA-N
Molecular Weight 272.341 g/mol
SMILES O[C@]1([C@@]2([C@@](OC(O2)(C)C)([C@](CC(OC(C)(C)C)=O)(C1)[H])[H])[H])[H]
SPLASH splash10-0udi-0090000000-ff373f5ed3db157f6b9e
Source of Spectrum F-54-4780-2
Wiley ID 806717