| SpectraBase Spectrum ID |
1HAzchLhdfY |
| Name |
Pentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene, 25,26,27,28-tetraethoxy-, stereoisomer |
| Alternate Name(s) |
25,26,27,28-tetraethoxypentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene
25,26,27,28-Tetrathoxycalix(4)arene |
| CAS Registry Number |
85703-94-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H40O4 |
| InChI |
InChI=1S/C36H40O4/c1-5-37-33-25-13-9-14-26(33)22-28-16-11-18-30(35(28)39-7-3)24-32-20-12-19-31(36(32)40-8-4)23-29-17-10-15-27(21-25)34(29)38-6-2/h9-20H,5-8,21-24H2,1-4H3 |
| InChIKey |
QXBVNELCTPEBSK-UHFFFAOYSA-N |
| Molecular Weight |
536.712 g/mol |
| SMILES |
c12c(c(Cc3c(c(Cc4c(c(Cc5c(c(C2)ccc5)OCC)ccc4)OCC)ccc3)OCC)ccc1)OCC |
| SPLASH |
splash10-000i-0000090000-1577c7b4a792fbcc02d1 |
| Source of Spectrum |
F-39-425-0 |
| Wiley ID |
1404142 |
![Pentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene, 25,26,27,28-tetraethoxy-, stereoisomer](/api/spectrum/1HAzchLhdfY/structure.png?h=300&w=458 "Pentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene, 25,26,27,28-tetraethoxy-, stereoisomer")
