| SpectraBase Spectrum ID |
K9T4XfpIr2x |
| Name |
1,6-Bis(3,5-di-tert-butylphenyl)hexa-1,5-diyne-3,4-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C34H42O2 |
| InChI |
InChI=1S/C34H42O2/c1-31(2,3)25-17-23(18-26(21-25)32(4,5)6)13-15-29(35)30(36)16-14-24-19-27(33(7,8)9)22-28(20-24)34(10,11)12/h17-22H,1-12H3 |
| InChIKey |
FQLGGKWGQLAAMI-UHFFFAOYSA-N |
| Molecular Weight |
482.708 g/mol |
| SMILES |
C(#Cc1cc(C(C)(C)C)cc(c1)C(C)(C)C)C(C(C#Cc1cc(C(C)(C)C)cc(c1)C(C)(C)C)=O)=O |
| SPLASH |
splash10-0006-0090000000-638b10031c109d327321 |
| Source of Spectrum |
KC-0-3749-1 |
| Synonyms |
1,6-bis(3,5-ditert-butylphenyl)-1,5-hexadiyne-3,4-dione |
| Wiley ID |
832043 |
