| SpectraBase Spectrum ID |
IRD16MIKz2p |
| Name |
9,13-bis(acetoxymethyl)-11-oxapentacyclo[6.5.0.0(1,12).0(8,10).0(9,13)]tridecane |
| Alternate Name(s) |
{13-[(acetyloxy)methyl]-11-oxapentacyclo[6.5.0.0(1,12).0(8,10).0(9,13)]tridec-9-yl}methyl acetate |
| CAS Registry Number |
106710-67-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24O5 |
| InChI |
InChI=1S/C18H24O5/c1-11(19)21-9-17-13-15(17)7-5-3-4-6-8-16(15)14(23-13)18(16,17)10-22-12(2)20/h13-14H,3-10H2,1-2H3/t13-,14-,15?,16?,17?,18?/m1/s1 |
| InChIKey |
ZLHKOTHIAAFILD-QAICXNGDSA-N |
| Molecular Weight |
320.385 g/mol |
| SMILES |
C12(C3([C@@]4(O[C@@]2(C11C34CCCCCC1)[H])[H])COC(=O)C)COC(=O)C |
| SPLASH |
splash10-0006-0900000000-c9efe628d803a9ca0130 |
| Source of Spectrum |
K-120-772-2 |
| Wiley ID |
1320138 |
![9,13-bis(acetoxymethyl)-11-oxapentacyclo[6.5.0.0(1,12).0(8,10).0(9,13)]tridecane](/api/spectrum/IRD16MIKz2p/structure.png?h=300&w=458 "9,13-bis(acetoxymethyl)-11-oxapentacyclo[6.5.0.0(1,12).0(8,10).0(9,13)]tridecane")
