| SpectraBase Spectrum ID |
A63kmnWTsQs |
| Name |
PHENOL, 4,4',4''-[(2,4,6-TRIMETHYL-1,3,5-BENZENETRIYL)TRIS(METHYLENE)]TRIS[2,6-b]- |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
774.595096369 u |
| Formula |
C54H78O3 |
| InChI |
InChI=1S/C54H78O3/c1-31-37(22-34-25-40(49(4,5)6)46(55)41(26-34)50(7,8)9)32(2)39(24-36-29-44(53(16,17)18)48(57)45(30-36)54(19,20)21)33(3)38(31)23-35-27-42(51(10,11)12)47(56)43(28-35)52(13,14)15/h25-30,55-57H,22-24H2,1-21H3 |
| InChIKey |
VSAWBBYYMBQKIK-UHFFFAOYSA-N |
| Molecular Weight |
775.215 g/mol |
| Nominal Mass |
774 u |
| Number of Peaks |
404 |
| SMILES |
CC(c1c(O)c(C(C)(C)C)cc(Cc2c(C)c(Cc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)c(C)c(Cc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)c2C)c1)(C)C |
| SPLASH |
splash10-05i0-5341010900-3ba52ceeddcb76106650 |
| Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Wiley ID |
MVX000017 |
