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(3a'R,4'R,6a'R)-2'-bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol

View entire compound with spectra: 1 MS (GC)

(3a'R,4'R,6a'R)-2'-bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol
SpectraBase Compound ID F0UcBlpdcmY
InChI InChI=1S/C14H23BrO4/c15-12-8-10-11(17)7-9(3-1-2-4-16)13(10)14(12)18-5-6-19-14/h9-13,16-17H,1-8H2/t9?,10-,11+,12?,13+/m0/s1
InChIKey UHPSTLNCWVYTSK-OLHXFANGSA-N
Mol Weight 335.24 g/mol
Molecular Formula C14H23BrO4
Exact Mass 334.077972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KASZpZnSaOu
Name (3a'R,4'R,6a'R)-2'-bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23BrO4
InChI InChI=1S/C14H23BrO4/c15-12-8-10-11(17)7-9(3-1-2-4-16)13(10)14(12)18-5-6-19-14/h9-13,16-17H,1-8H2/t9?,10-,11+,12?,13+/m0/s1
InChIKey UHPSTLNCWVYTSK-OLHXFANGSA-N
Molecular Weight 335.238 g/mol
SMILES O[C@]1([C@@]2(CC(C3([C@@]2(C(CCCCO)C1)[H])OCCO3)Br)[H])[H]
SPLASH splash10-0002-9211000000-89d69df9244a4e3fc6d2
Source of Spectrum F-69-7378-22b
Synonyms (4'R)-2'-Bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[1,3-dioxolane-2,12-pentalen]-4'-ol (3a'R,4'R,6a'R)-2'-bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[[1,3]dioxolane-2,1'-pentalen]-4'-ol
Wiley ID 1738303