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(7R,7aS)-4,4,7a-trimethyl-2-spiro[5,6-dihydrobenzofuran-7,2'-oxirane]one
SpectraBase Compound ID ApxWmderP8U
InChI InChI=1S/C12H16O3/c1-10(2)4-5-12(7-14-12)11(3)8(10)6-9(13)15-11/h6H,4-5,7H2,1-3H3/t11-,12+/m0/s1
InChIKey XHEGXVAWDSUIIG-NWDGAFQWSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBQjractDWf
Name (7R,7aS)-4,4,7a-trimethyl-2-spiro[5,6-dihydrobenzofuran-7,2'-oxirane]one
Alternate Name(s) (7R,7aS)-4,4,7a-trimethylspiro[5,6-dihydro-1-benzofuran-7,2'-oxirane]-2-one (7R,7aS)-4,4,7a-trimethylspiro[5,6-dihydrobenzofuran-7,2'-oxirane]-2-one
CAS Registry Number 91186-45-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-10(2)4-5-12(7-14-12)11(3)8(10)6-9(13)15-11/h6H,4-5,7H2,1-3H3/t11-,12+/m0/s1
InChIKey XHEGXVAWDSUIIG-NWDGAFQWSA-N
Molecular Weight 208.257 g/mol
SMILES [C@]12([C@@]3(OC3)CCC(C1=CC(O2)=O)(C)C)C
SPLASH splash10-0006-9500000000-698e1f157bdbf0f9b234
Source of Spectrum H-67-828-0
Wiley ID 1206834