SpectraBase Spectrum ID |
E6m0iJKcCxZ |
Name |
cone-25,26,27,28-Tetrakis(propyloxy)-5,11,17,23-tetrakis[1-(2,3,4,5-tetraphenyl)phenyl]calix[4]arene |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C160H128O4 |
InChI |
InChI=1S/C160H128O4/c1-5-89-161-157-129-93-125(141-105-137(109-57-25-9-26-58-109)145(113-65-33-13-34-66-113)153(121-81-49-21-50-82-121)149(141)117-73-41-17-42-74-117)94-130(157)102-132-96-127(143-107-139(111-61-29-11-30-62-111)147(115-69-37-15-38-70-115)155(123-85-53-23-54-86-123)151(143)119-77-45-19-46-78-119)98-134(159(132)163-91-7-3)104-136-100-128(144-108-140(112-63-31-12-32-64-112)148(116-71-39-16-40-72-116)156(124-87-55-24-56-88-124)152(144)120-79-47-20-48-80-120)99-135(160(136)164-92-8-4)103-133-97-126(95-131(101-129)158(133)162-90-6-2)142-106-138(110-59-27-10-28-60-110)146(114-67-35-14-36-68-114)154(122-83-51-22-52-84-122)150(142)118-75-43-18-44-76-118/h9-88,93-100,105-108H,5-8,89-92,101-104H2,1-4H3 |
InChIKey |
GXUNFJSTAYPGAG-UHFFFAOYSA-N |
Molecular Weight |
2114.780 g/mol |
SMILES |
c1(c(c(-c2ccccc2)c(c(c1)-c1ccccc1)-c1ccccc1)-c1ccccc1)-c1cc2Cc3c(c(Cc4cc(-c5c(c(-c6ccccc6)c(c(c5)-c5ccccc5)-c5ccccc5)-c5ccccc5)cc(Cc5c(c(Cc(c1)c2OCCC)cc(-c1c(c(-c2ccccc2)c(c(c1)-c1ccccc1)-c1ccccc1)-c1ccccc1)c5)OCCC)c4OCCC)cc(-c1c(c(-c2ccccc2)c(c(c1)-c1ccccc1)-c1ccccc1)-c1ccccc1)c3)OCCC |
SPLASH |
splash10-0006-9000000000-f1ef4fdbad0869a67bb5 |
Source of Spectrum |
K1-0-4958-3 |
Wiley ID |
1589714 |