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2,2-Dimethyl-1,3-cyclopentanedione
SpectraBase Compound ID GsKbcapBwxJ
InChI InChI=1S/C7H10O2/c1-7(2)5(8)3-4-6(7)9/h3-4H2,1-2H3
InChIKey VXVZVJNSRQRUTI-UHFFFAOYSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9xLmCEfjGtt
Name 1,3-Cyclopentanedione, 2,2-dimethyl-
Alternate Name(s) 2,2-Dimethyl-1,3-cyclopentanedione 2,2-Dimethylcyclopentane-1,3-dione 2,2-Dimethylcyclopentane-1,3-quinone
CAS Registry Number 3883-58-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-7(2)5(8)3-4-6(7)9/h3-4H2,1-2H3
InChIKey VXVZVJNSRQRUTI-UHFFFAOYSA-N
Molecular Weight 126.155 g/mol
SMILES C1(C(CCC1=O)=O)(C)C
SPLASH splash10-00fu-9200000000-1327b14c7d238deaae8e
Source of Spectrum I-68-809-17
Wiley ID 1129875