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(3aR,8aR)-2,2-dimethyl-4,8a-dihydro-3aH-[1,3]dioxolo[4,5-c]oxepin-8-one
SpectraBase Compound ID u6ScLrIoZM
InChI InChI=1S/C9H12O4/c1-9(2)12-7-5-11-4-3-6(10)8(7)13-9/h3-4,7-8H,5H2,1-2H3/t7-,8+/m1/s1
InChIKey DSEXYVBWSSNIFF-SFYZADRCSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcUPSF0Avya
Name (3aR,8aR)-2,2-dimethyl-4,8a-dihydro-3aH-[1,3]dioxolo[4,5-c]oxepin-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-9(2)12-7-5-11-4-3-6(10)8(7)13-9/h3-4,7-8H,5H2,1-2H3/t7-,8+/m1/s1
InChIKey DSEXYVBWSSNIFF-SFYZADRCSA-N
Molecular Weight 184.191 g/mol
SMILES [C@@]12(OC(C)(C)O[C@@]2(COC=CC1=O)[H])[H]
SPLASH splash10-0aor-9700000000-f19136bd0287816f636c
Source of Spectrum KC-57-2347-4
Wiley ID 1623445