| SpectraBase Spectrum ID |
5G8KakWc4G |
| Name |
(Z)-1-Benzylthio-1,4-di(p-cyclohexylphenyl)-1-buten-3-yne |
| Alternate Name(s) |
1-[(3Z)-4-(benzylsulfanyl)-4-(4-cyclohexylphenyl)-3-buten-1-ynyl]-4-cyclohexylbenzene
benzyl (1Z)-1,4-bis(4-cyclohexylphenyl)-1-buten-3-ynyl sulfide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H38S |
| InChI |
InChI=1S/C35H38S/c1-4-11-29(12-5-1)27-36-35(34-25-23-33(24-26-34)31-16-8-3-9-17-31)18-10-13-28-19-21-32(22-20-28)30-14-6-2-7-15-30/h1,4-5,11-12,18-26,30-31H,2-3,6-9,14-17,27H2/b35-18- |
| InChIKey |
XDQVKZVEDPUQGV-AEUUOICLSA-N |
| Molecular Weight |
490.749 g/mol |
| SMILES |
C(\C=C\(c1ccc(cc1)C1CCCCC1)SCc1ccccc1)#Cc1ccc(cc1)C1CCCCC1 |
| SPLASH |
splash10-00kf-0006900000-f15cfa3cbabd471fb2cc |
| Source of Spectrum |
F-52-12687-3 |
| Wiley ID |
799134 |
