| SpectraBase Spectrum ID |
BsNckEiuZGL |
| Name |
Benzene, [[(1-ethyl-2-iodo-1-butenyl)thio]methyl]-, (E)- |
| Alternate Name(s) |
(E)-3-Benzylthio-4-iodohex-3-ene
({[(1E)-1-ethyl-2-iodo-1-butenyl]sulfanyl}methyl)benzene
benzyl (1E)-1-ethyl-2-iodo-1-butenyl sulfide |
| CAS Registry Number |
112701-55-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17IS |
| InChI |
InChI=1S/C13H17IS/c1-3-12(14)13(4-2)15-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3/b13-12+ |
| InChIKey |
XQTGOSWHYNGLJT-OUKQBFOZSA-N |
| Molecular Weight |
332.243 g/mol |
| SMILES |
C(\C(=C\(SCc1ccccc1)CC)I)C |
| SPLASH |
splash10-0006-9000000000-453deac6369e6507b5f2 |
| Source of Spectrum |
KC-1987-1019-2 |
| Wiley ID |
1329023 |
