| SpectraBase Spectrum ID |
4M1lem8Mddp |
| Name |
(3aR*,4S*,5S*,6aR*)-5-Hydroxy-4-methyl-3,3a,4,5,6,6a-hexahydropentalen-1-carboxylic acid methyl ester |
| Alternate Name(s) |
methyl (3aR,4S,5S,6aR)-5-hydroxy-4-methyl-3,3a,4,5,6,6a-hexahydro-1-pentalenecarboxylate
methyl (3aR,4S,5S,6aR)-5-hydroxy-4-methyl-3,3a,4,5,6,6a-hexahydropentalene-1-carboxylate
methyl (3aR,4S,5S,6aR)-4-methyl-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalene-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H16O3 |
| InChI |
InChI=1S/C11H16O3/c1-6-7-3-4-8(11(13)14-2)9(7)5-10(6)12/h4,6-7,9-10,12H,3,5H2,1-2H3/t6-,7-,9+,10-/m0/s1 |
| InChIKey |
NVVSARDPXJBKDU-MFDQJXRNSA-N |
| Molecular Weight |
196.246 g/mol |
| SMILES |
O[C@]1(C[C@]2(C(=CC[C@]2([C@@]1(C)[H])[H])C(=O)OC)[H])[H] |
| SPLASH |
splash10-014i-0900000000-08fc94f8b72a094cfa77 |
| Source of Spectrum |
J-64-661-13 |
| Wiley ID |
1529193 |
