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Cyclopenta-1,3-dioxin-4(4aH)-one, 2-(1,1-dimethylethyl)tetrahydro-4a-(2-propenyl)-, [2S-(2.alpha.,4a.beta.,7a.beta.)]-
SpectraBase Compound ID 1xHKoIDv1z0
InChI InChI=1S/C14H22O3/c1-5-8-14-9-6-7-10(14)16-12(13(2,3)4)17-11(14)15/h5,10,12H,1,6-9H2,2-4H3/t10-,12-,14-/m0/s1
InChIKey BTMIAFKBMLILPL-JKOKRWQUSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Ln6h2k9PJ4
Name Cyclopenta-1,3-dioxin-4(4aH)-one, 2-(1,1-dimethylethyl)tetrahydro-4a-(2-propenyl)-, [2S-(2.alpha.,4a.beta.,7a.beta.)]-
CAS Registry Number 124898-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-5-8-14-9-6-7-10(14)16-12(13(2,3)4)17-11(14)15/h5,10,12H,1,6-9H2,2-4H3/t10-,12-,14-/m0/s1
InChIKey BTMIAFKBMLILPL-JKOKRWQUSA-N
Molecular Weight 238.327 g/mol
SMILES [C@@]12(C(O[C@](O[C@]2(CCC1)[H])(C(C)(C)C)[H])=O)CC=C
SPLASH splash10-05ox-9600000000-aae19e66f8bd98c12fd9
Source of Spectrum H-72-702-5
Synonyms (2S,4aR,7aS)-4a-allyl-2-(t-butyl)-5,6,7,7a-tetrahydrocyclopenta[d]dioxin-4(4aH)-one (2S,4aR,7aS)-4a-allyl-2-tert-butyltetrahydrocyclopenta[d][1,3]dioxin-4(4aH)-one
Wiley ID 1240799