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1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-4,5-dimethyl-
SpectraBase Compound ID 8u9itt7sqZn
InChI InChI=1S/C10H12O3/c1-5-3-4-7-8(6(5)2)10(12)13-9(7)11/h3,6-8H,4H2,1-2H3
InChIKey JTQIJOSTTCDFGH-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dFvQjQAASB
Name 1,3-ISOBENZOFURANDIONE, 3A,4,7,7A-TETRAHYDRO-4,5-DIMETHYL-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-5-3-4-7-8(6(5)2)10(12)13-9(7)11/h3,6-8H,4H2,1-2H3
InChIKey JTQIJOSTTCDFGH-UHFFFAOYSA-N
Molecular Weight 180.0783
SMILES C=1(C(C2C(C(=O)OC2=O)CC1)C)C
SPLASH splash10-052f-9500000000-f1c931ba01013d6bd3f7
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany