| SpectraBase Spectrum ID |
31NDGyp4wKC |
| Name |
1-[2-(Mercaptomethyl)phenyl]-3-methyl-2-butanol |
| Alternate Name(s) |
1-[2-(mercaptomethyl)phenyl]-3-methyl-butan-2-ol
3-methyl-1-[2-(sulfanylmethyl)phenyl]butan-2-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18OS |
| InChI |
InChI=1S/C12H18OS/c1-9(2)12(13)7-10-5-3-4-6-11(10)8-14/h3-6,9,12-14H,7-8H2,1-2H3 |
| InChIKey |
OWXQWNVDGCTWJU-UHFFFAOYSA-N |
| Molecular Weight |
210.335 g/mol |
| SMILES |
SCc1c(CC(C(C)C)O)cccc1 |
| SPLASH |
splash10-0udi-0900000000-3ef4249f3da19ac02b54 |
| Source of Spectrum |
J-61-1861-3 |
| Wiley ID |
1209115 |
![1-[2-(Mercaptomethyl)phenyl]-3-methyl-2-butanol](/api/spectrum/31NDGyp4wKC/structure.png?h=300&w=458 "1-[2-(Mercaptomethyl)phenyl]-3-methyl-2-butanol")
