SpectraBase Compound ID | H6r1ujtTX3n |
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InChI | InChI=1S/C6H6O3/c7-5-2-1-4-3-8-6(5)9-4/h1-2,4,6H,3H2/t4-,6+/m1/s1 |
InChIKey | HITOXZPZGPXYHY-XINAWCOVSA-N |
Mol Weight | 126.11 g/mol |
Molecular Formula | C6H6O3 |
Exact Mass | 126.031694 g/mol |
SpectraBase Spectrum ID | FbMIoMN82O4 |
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Name | (1R)-6,8-DIOXABICYCLO[3.2.1]OCT-2-EN-4-ONE |
Source of Sample | Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan |
CAS Registry Number | 37112-31-5 |
Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C6H6O3 |
InChI | InChI=1S/C6H6O3/c7-5-2-1-4-3-8-6(5)9-4/h1-2,4,6H,3H2/t4-,6+/m1/s1 |
InChIKey | HITOXZPZGPXYHY-XINAWCOVSA-N |
Instrument Name | BRUKER AC-300 |
Molecular Weight | 126.11 |
Solvent | CDCl3; Reference=TMS; Temperature 297K |