SpectraBase Compound ID | 4PCPZDyllRf |
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InChI | InChI=1S/C13H18O3/c1-2-9-6-12(14)11-5-10(9)7-13(8-11)15-3-4-16-13/h2,9-11H,1,3-8H2/t9?,10-,11+/m0/s1 |
InChIKey | CHFUQOCHJPHLFT-QXXIUIOUSA-N |
Mol Weight | 222.28 g/mol |
Molecular Formula | C13H18O3 |
Exact Mass | 222.125594 g/mol |
SpectraBase Spectrum ID | 6Vg44cNouIq |
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Name | |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C13H18O3 |
InChI | InChI=1S/C13H18O3/c1-2-9-6-12(14)11-5-10(9)7-13(8-11)15-3-4-16-13/h2,9-11H,1,3-8H2/t9?,10-,11+/m0/s1 |
InChIKey | CHFUQOCHJPHLFT-QXXIUIOUSA-N |
Molecular Weight | 222.1251 |
SMILES | [C@]12(C[C@@](CC3(OCCO3)C1)(C(C=C)CC2=O)[H])[H] |
SPLASH | splash10-0002-9100000000-ece099615f458c2f57a4 |
Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |