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3,7-Epoxy-2,2,7-trimethyl-4-oxo-2,3,4,7-tetrahydro-oxepin
SpectraBase Compound ID LeZOsvPQ4Qa
InChI InChI=1S/C9H12O3/c1-8(2)7-6(10)4-5-9(3,11-7)12-8/h4-5,7H,1-3H3
InChIKey YTLBDCYIGPBDMD-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12eDSUb1riM
Name 3,7-Epoxy-2,2,7-trimethyl-4-oxo-2,3,4,7-tetrahydro-oxepin
Alternate Name(s) 5,7,7-trimethyl-6,8-dioxabicyclo[3.2.1]oct-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-8(2)7-6(10)4-5-9(3,11-7)12-8/h4-5,7H,1-3H3
InChIKey YTLBDCYIGPBDMD-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C12(OC(C)(C)C(O2)C(C=C1)=O)C
SPLASH splash10-000t-9300000000-18b38a61dc9d84283776
Source of Spectrum F-47-6419-7
Wiley ID 1164394