| SpectraBase Spectrum ID |
JaUYXW7OTcM |
| Name |
cis-1,5-Bis(6-ethynylcyclohepta-1,3,5-trienyl)-3-thiapenta-1,4-diene |
| Alternate Name(s) |
(E)-2-(6-ethynyl-1,3,5-cycloheptatrien-1-yl)ethenyl (Z)-2-(6-ethynyl-1,3,5-cycloheptatrien-1-yl)ethenyl sulfide
1-ethynyl-6-((E)-2-{[(Z)-2-(6-ethynyl-1,3,5-cycloheptatrien-1-yl)ethenyl]sulfanyl}ethenyl)-1,3,5-cycloheptatriene
1-ethynyl-6-[(Z)-2-[[(E)-2-(6-ethynyl-1-cyclohepta-1,3,5-trienyl)ethenyl]thio]ethenyl]cyclohepta-1,3,5-triene
1-ethynyl-6-[(Z)-2-[(E)-2-(6-ethynylcyclohepta-1,3,5-trien-1-yl)vinyl]sulfanylvinyl]cyclohepta-1,3,5-triene
1-ethynyl-6-[(Z)-2-[(E)-2-(6-ethynylcyclohepta-1,3,5-trien-1-yl)ethenyl]sulfanylethenyl]cyclohepta-1,3,5-triene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H18S |
| InChI |
InChI=1S/C22H18S/c1-3-19-9-5-7-11-21(17-19)13-15-23-16-14-22-12-8-6-10-20(4-2)18-22/h1-2,5-16H,17-18H2/b15-13-,16-14+ |
| InChIKey |
SQWPWNHTTOIODX-VCFJNTAESA-N |
| Molecular Weight |
314.446 g/mol |
| SMILES |
C(#C)C1=CC=CC=C(C1)\C=C\S\C=C/C1=CC=CC=C(C#C)C1 |
| SPLASH |
splash10-0a4i-9000000000-6aa17957d1c41d846fec |
| Source of Spectrum |
PS-0-2760-9 |
| Wiley ID |
786824 |
