Basic Information |
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| Product Name： | CALCIUM2-ISOVALERYL-1,3-INDANDIONE |
| CAS： | 23710-76-1 |
| English Synonyms： | CALCIUM2-ISOVALERYL-1,3-INDANDIONE |
| MDL Number.： | MFCD01747023 |
| H bond acceptor： | 6 |
| H bond donor： | 0 |
| Smile： | CC(C)CC(=O)C1=C(c2ccccc2C1=O)O[Ca]OC3=C(C(=O)c4c3cccc4)C(=O)CC(C)C |
| InChi： | InChI=1S/2C14H14O3.Ca/c2*1-8(2)7-11(15)12-13(16)9-5-3-4-6-10(9)14(12)17;/h2*3-6,8,16H,7H2,1-2H3;/q;;+2/p-2 |
| InChiKey： | InChIKey=QPYPHJWZWLGYRR-UHFFFAOYSA-L |
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