SpectraBase Spectrum ID |
GU4u9mvBaMD |
Name |
Undecacyclo-[12.10.0.0(1,20).0(2,6).0(4,11).0(5,9).0(7,20).0(10,17).0(12,16).0(15,19).0(21,24)]-tetracosa-10,22-diene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
312.187800773 u |
Formula |
C24H24 |
InChI |
InChI=1S/C24H24/c1-2-12-11(1)23-13-3-7-17-8-4-14(23)22-16-6-10(20(8)22)18(17)9-5-15(24(12,16)23)21(13)19(7)9/h1-2,7-16,19-22H,3-6H2 |
InChIKey |
MAJYHOPKCUIRAQ-UHFFFAOYSA-N |
SMILES |
C1C2C34C5(C6C7C4CC4C8=C(C9CC5C2C9C18)C(C6)C74)C1C3C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938406 |