| SpectraBase Spectrum ID |
ztw0FKCGIm |
| Name |
1-[bis(3,6-ditert-butyl-1-azulenyl)methyl]-3,6-ditert-butylazulene |
| Alternate Name(s) |
1-[bis(3,6-ditert-butylazulen-1-yl)methyl]-3,6-ditert-butyl-azulene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C55H70 |
| InChI |
InChI=1S/C55H70/c1-50(2,3)34-19-25-37-40(28-22-34)46(53(10,11)12)31-43(37)49(44-32-47(54(13,14)15)41-29-23-35(51(4,5)6)20-26-38(41)44)45-33-48(55(16,17)18)42-30-24-36(52(7,8)9)21-27-39(42)45/h19-33,49H,1-18H3 |
| InChIKey |
QCMZPLZZWDBOQQ-UHFFFAOYSA-N |
| Molecular Weight |
731.165 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)c1c2c(ccc(cc2)C(C)(C)C)c(c1)C(C)(C)C |
| SPLASH |
splash10-00di-0000009100-c421b6f0110005489fdc |
| Source of Spectrum |
AJ-68-1427-9 |
| Wiley ID |
773294 |
![1-[bis(3,6-ditert-butyl-1-azulenyl)methyl]-3,6-ditert-butylazulene](/api/spectrum/ztw0FKCGIm/structure.png?h=300&w=458 "1-[bis(3,6-ditert-butyl-1-azulenyl)methyl]-3,6-ditert-butylazulene")
