SpectraBase Spectrum ID |
LalJRvsSZsm |
Name |
Octaethyl [benzo[e,e']di-1,3-dithiacyclohept-2,2'-diylidene)(bismethylene)tetraphosphonate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H50O12P4S4 |
InChI |
InChI=1S/C30H50O12P4S4/c1-9-35-43(31,36-10-2)27(44(32,37-11-3)38-12-4)29-47-19-23-17-25-21-49-30(50-22-26(25)18-24(23)20-48-29)28(45(33,39-13-5)40-14-6)46(34,41-15-7)42-16-8/h17-18H,9-16,19-22H2,1-8H3 |
InChIKey |
PPKBFYYUTJMDTN-UHFFFAOYSA-N |
Molecular Weight |
854.853 g/mol |
SMILES |
C(P(=O)(OCC)OCC)(P(=O)(OCC)OCC)=C1SCc2cc3CSC(=C(P(=O)(OCC)OCC)P(=O)(OCC)OCC)SCc3cc2CS1 |
SPLASH |
splash10-0002-9000000000-b3f7bae1689aa7306092 |
Source of Spectrum |
SO-0-1229-6 |
Wiley ID |
1542796 |