| SpectraBase Spectrum ID |
LHLjKmyWkig |
| Name |
Pentacyclo[26.2.2.2(4,7).2(12,15).2(20,23)]octatriaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,31,33,35,37-nonadecaene, (E,Z,Z,E,Z,E,Z)- |
| Alternate Name(s) |
pentacyclo[26.2.2.2(4,7).2(12,15).2(20,23)]octatriaconta-1(30),2,4,6,8,10,12,14,16,18,20,22,24,26,28,31,33,35,37-nonadecaene
[2(1)para[4(3)]paracyclophane |
| CAS Registry Number |
77972-51-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C38H30 |
| InChI |
InChI=1S/C38H30/c1-2-8-32-15-19-34(20-16-32)10-4-6-12-36-23-27-38(28-24-36)30-29-37-25-21-35(22-26-37)11-5-3-9-33-17-13-31(7-1)14-18-33/h1-30H/b2-1-,5-3-,6-4-,7-1-,8-2-,9-3-,10-4-,11-5-,12-6-,30-29-,31-7-,32-8-,33-9-,34-10-,35-11-,36-12-,37-29-,38-30- |
| InChIKey |
PFHSLHVIOFWGFR-BPNBVNHDSA-N |
| Molecular Weight |
486.658 g/mol |
| SMILES |
c12\C=C/c3ccc(\C=C/C=C\c4ccc(\C=C/C=C\c5ccc(\C=C/C=C\c(cc2)cc1)cc5)cc4)cc3 |
| SPLASH |
splash10-000i-0000900000-c0845935ca6274ff5bb9 |
| Source of Spectrum |
KC-1981-667-0 |
| Wiley ID |
1396652 |
![Pentacyclo[26.2.2.2(4,7).2(12,15).2(20,23)]octatriaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,31,33,35,37-nonadecaene, (E,Z,Z,E,Z,E,Z)-](/api/spectrum/LHLjKmyWkig/structure.png?h=300&w=458 "Pentacyclo[26.2.2.2(4,7).2(12,15).2(20,23)]octatriaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,31,33,35,37-nonadecaene, (E,Z,Z,E,Z,E,Z)-")
