| SpectraBase Spectrum ID |
9hm1LZIO2FZ |
| Name |
2-methyl-3-(phenylsulfanyl)propanal |
| Alternate Name(s) |
2-Methyl-3-(phenylthio)propanal
2-methyl-3-phenylsulfanylpropanal
2-methyl-3-phenylsulfanyl-propanal |
| CAS Registry Number |
56102-14-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H12OS |
| InChI |
InChI=1S/C10H12OS/c1-9(7-11)8-12-10-5-3-2-4-6-10/h2-7,9H,8H2,1H3 |
| InChIKey |
SMEGYJOSARNLFG-UHFFFAOYSA-N |
| Molecular Weight |
180.265 g/mol |
| SMILES |
C(Sc1ccccc1)C(C=O)C |
| SPLASH |
splash10-03di-0900000000-0addf0b87b1d596cc9f5 |
| Source of Spectrum |
F-54-2695-17 |
| Wiley ID |
806191 |
