| SpectraBase Spectrum ID |
3v1F2wgqkbb |
| Name |
3-hydroxy-1-adamantanecarboxylic acid ethyl ester |
| Alternate Name(s) |
3-hydroxyadamantane-1-carboxylic acid ethyl ester
ethyl 3-hydroxyadamantane-1-carboxylate
ethyl 3-oxidanyladamantane-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O3 |
| InChI |
InChI=1S/C13H20O3/c1-2-16-11(14)12-4-9-3-10(5-12)7-13(15,6-9)8-12/h9-10,15H,2-8H2,1H3/t9-,10?,12+,13-/m0/s1 |
| InChIKey |
VVWVYPCOMWTLII-DUHZLVNYSA-N |
| Molecular Weight |
224.300 g/mol |
| SMILES |
O[C@]12C[C@@]3(C(=O)OCC)CC(C2)C[C@@](C3)(C1)[H] |
| SPLASH |
splash10-0udi-0900000000-1f08b98771de59808483 |
| Source of Spectrum |
J-60-5677-5 |
| Wiley ID |
1225388 |
