SpectraBase Spectrum ID |
JMLIETfxkgY |
Name |
1,6-ditert-butyl-3-[(3,6-ditert-butylazulen-1-yl)-phenyl-methyl]azulene |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C43H52 |
InChI |
InChI=1S/C43H52/c1-40(2,3)29-18-22-31-33(24-20-29)37(42(7,8)9)26-35(31)39(28-16-14-13-15-17-28)36-27-38(43(10,11)12)34-25-21-30(41(4,5)6)19-23-32(34)36/h13-27,39H,1-12H3 |
InChIKey |
UZYBJAFDFKXFPM-UHFFFAOYSA-N |
Molecular Weight |
568.889 g/mol |
SMILES |
c1(c2c(ccc(cc2)C(C)(C)C)c(c1)C(C)(C)C)C(c1c2c(ccc(cc2)C(C)(C)C)c(c1)C(C)(C)C)c1ccccc1 |
SPLASH |
splash10-014i-0000090000-3e92addbeaeb541062c2 |
Source of Spectrum |
AJ-68-1430-10 |
Synonyms |
1,6-ditert-butyl-3-[(3,6-ditert-butyl-1-azulenyl)-phenylmethyl]azulene |
Wiley ID |
773286 |