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(3aRS,7RS,7aRS)-Perhydro-spiro[isobenzofuran-7,2'-oxirane]-1-one
SpectraBase Compound ID 3PXB8zhbmXW
InChI InChI=1S/C9H12O3/c10-8-7-6(4-11-8)2-1-3-9(7)5-12-9/h6-7H,1-5H2
InChIKey WQXSPQFNZNGOGP-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 70eGV5PlVfU
Name (3aRS,7RS,7aRS)-Perhydro-spiro[isobenzofuran-7,2'-oxirane]-1-one
Alternate Name(s) Hexahydro-1H-spiro[2-benzofuran-4,2'-oxirane]-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c10-8-7-6(4-11-8)2-1-3-9(7)5-12-9/h6-7H,1-5H2
InChIKey WQXSPQFNZNGOGP-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C12(C3C(OCC3CCC1)=O)OC2
SPLASH splash10-014l-0900000000-c5e4cb39232793df1aec
Source of Spectrum AH-126-1209-3
Wiley ID 1164413