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1,1-Dimethyl-5-hydroxy-1,3-dihydroisobenzofuran-3-one
SpectraBase Compound ID 6XAibzHARSz
InChI InChI=1S/C10H10O3/c1-10(2)8-4-3-6(11)5-7(8)9(12)13-10/h3-5,11H,1-2H3
InChIKey HHMGOFQHPYZOBW-UHFFFAOYSA-N
Mol Weight 178.19 g/mol
Molecular Formula C10H10O3
Exact Mass 178.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PvBbDsgK87
Name 1,1-Dimethyl-5-hydroxy-1,3-dihydroisobenzofuran-3-one
Alternate Name(s) 6-hydroxy-3,3-dimethyl-2-benzofuran-1(3H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C10H10O3
InChI InChI=1S/C10H10O3/c1-10(2)8-4-3-6(11)5-7(8)9(12)13-10/h3-5,11H,1-2H3
InChIKey HHMGOFQHPYZOBW-UHFFFAOYSA-N
Molecular Weight 178.187 g/mol
SMILES Oc1cc2C(OC(C)(C)c2cc1)=O
SPLASH splash10-03di-0900000000-1bf3472c3883bcbd8d8c
Source of Spectrum J-60-6172-14
Wiley ID 1173991