For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
syn-5,6,15,16-Tetrakis(methoxycarbonyl)-4,7,14,17-tetraphenyl[2.2](5,8)phthalazinophane
SpectraBase Compound ID FA6SjMgv91L
InChI InChI=1S/C56H44O8/c1-61-53(57)49-45(33-17-9-5-10-18-33)41-37-25-26-38(42(41)46(50(49)54(58)62-2)34-19-11-6-12-20-34)31-32-40-28-27-39(30-29-37)43-44(40)48(36-23-15-8-16-24-36)52(56(60)64-4)51(55(59)63-3)47(43)35-21-13-7-14-22-35/h5-28H,29-32H2,1-4H3
InChIKey ABHPILXDLQTXAL-UHFFFAOYSA-N
Mol Weight 845.0 g/mol
Molecular Formula C56H44O8
Exact Mass 844.303618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID E3ocXEn0aPh
Name syn-5,6,15,16-Tetrakis(methoxycarbonyl)-4,7,14,17-tetraphenyl[2.2](5,8)phthalazinophane
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C56H44O8
InChI InChI=1S/C56H44O8/c1-61-53(57)49-45(33-17-9-5-10-18-33)41-37-25-26-38(42(41)46(50(49)54(58)62-2)34-19-11-6-12-20-34)31-32-40-28-27-39(30-29-37)43-44(40)48(36-23-15-8-16-24-36)52(56(60)64-4)51(55(59)63-3)47(43)35-21-13-7-14-22-35/h5-28H,29-32H2,1-4H3
InChIKey ABHPILXDLQTXAL-UHFFFAOYSA-N
Molecular Weight 844.960 g/mol
SMILES c1(c(c(-c2ccccc2)c2c(c1-c1ccccc1)c1ccc2CCc2c3c(c(C(=O)OC)c(c(c3c(CC1)cc2)-c1ccccc1)C(=O)OC)-c1ccccc1)C(=O)OC)C(=O)OC
SPLASH splash10-00fr-0321700490-e584e1e58cb1eec8784d
Source of Spectrum KC-1-759-3
Wiley ID 1577678