| SpectraBase Spectrum ID |
BcjEwFrANUP |
| Name |
1,3-Cyclobutanedicarboxylic acid, 2-hydroxy-2,4,4-trimethyl-, dimethyl ester, (1.alpha.,2.alpha.,3.beta.)- |
| CAS Registry Number |
86554-42-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H18O5 |
| InChI |
InChI=1S/C11H18O5/c1-10(2)6(8(12)15-4)11(3,14)7(10)9(13)16-5/h6-7,14H,1-5H3/t6-,7-/m0/s1 |
| InChIKey |
DFIKPGYIQVHANQ-BQBZGAKWSA-N |
| Molecular Weight |
230.260 g/mol |
| SMILES |
OC1([C@](C([C@@]1(C(=O)OC)[H])(C)C)(C(=O)OC)[H])C |
| SPLASH |
splash10-0159-8900000000-ee1506f4a028d64364b3 |
| Source of Spectrum |
F-39-852-0 |
| Synonyms |
dimethyl (1S,3S)-2-hydroxy-2,4,4-trimethyl-1,3-cyclobutanedicarboxylate
Dimethyl 1,3,3-trimethylcyclobutan-1-ol-2,4-dicarboxylate |
| Wiley ID |
1231446 |
