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Pyrano[3,2-b]pyran-2(3H)-one, hexahydro-, cis-
SpectraBase Compound ID Akhy7kk369W
InChI InChI=1S/C8H12O3/c9-8-4-3-6-7(11-8)2-1-5-10-6/h6-7H,1-5H2
InChIKey BPYDYQQKJTYIAB-UHFFFAOYSA-N
Mol Weight 156.18 g/mol
Molecular Formula C8H12O3
Exact Mass 156.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ABE4mAOGicH
Name Pyrano[3,2-b]pyran-2(3H)-one, hexahydro-, cis- (D2)
Alternate Name(s) 4,4a,6,7,8,8a-hexahydro-3H-pyrano[3,2-b]pyran-2-one (D2) Hexahydropyrano[3,2-b]pyran-2(3H)-one (D2)
CAS Registry Number 39840-95-4
Comments Note: The molecular formula of the structure shown is C8H12O3 - which differs from the formula reported for the mass spectrum (C8H10D2O3)
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Formula C8H10D2O3
InChI InChI=1S/C8H12O3/c9-8-4-3-6-7(11-8)2-1-5-10-6/h6-7H,1-5H2
InChIKey BPYDYQQKJTYIAB-UHFFFAOYSA-N
Molecular Weight 156.181 g/mol
SMILES C12C(OCCC2)CCC(O1)=O
SPLASH splash10-00di-9100000000-20947c381944b25ad00a
Wiley ID 1488746