| SpectraBase Spectrum ID |
jTcSSlglt5 |
| Name |
2-[2-[(3aS,6aS)-1,1,5,5-tetramethyl-3a,4,6,6a-tetrahydropentalen-2-yl]ethyl]malonic acid diethyl ester |
| Alternate Name(s) |
2-[2-[(3aS,6aS)-1,1,5,5-tetramethyl-3a,4,6,6a-tetrahydropentalen-2-yl]ethyl]propanedioic acid diethyl ester
diethyl 2-[2-[(3aS,6aS)-1,1,5,5-tetramethyl-3a,4,6,6a-tetrahydropentalen-2-yl]ethyl]propanedioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H34O4 |
| InChI |
InChI=1S/C21H34O4/c1-7-24-18(22)16(19(23)25-8-2)10-9-15-11-14-12-20(3,4)13-17(14)21(15,5)6/h11,14,16-17H,7-10,12-13H2,1-6H3/t14-,17+/m1/s1 |
| InChIKey |
UPAARVQPJFCWPP-PBHICJAKSA-N |
| Molecular Weight |
350.499 g/mol |
| SMILES |
C=1(C([C@]2(CC(C[C@]2(C1)[H])(C)C)[H])(C)C)CCC(C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-0006-0901000000-3062ce090cf7cb2c9c33 |
| Source of Spectrum |
F-54-10716-10 |
| Wiley ID |
808693 |
![2-[2-[(3aS,6aS)-1,1,5,5-tetramethyl-3a,4,6,6a-tetrahydropentalen-2-yl]ethyl]malonic acid diethyl ester](/api/spectrum/jTcSSlglt5/structure.png?h=300&w=458 "2-[2-[(3aS,6aS)-1,1,5,5-tetramethyl-3a,4,6,6a-tetrahydropentalen-2-yl]ethyl]malonic acid diethyl ester")
