| SpectraBase Spectrum ID |
90tiB3ePyet |
| Name |
trans-4-(1-Methylethyl)-3-[(phenylthio)methyl]-1-oxetan-2-one |
| CAS Registry Number |
135638-67-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O2S |
| InChI |
InChI=1S/C13H16O2S/c1-9(2)12-11(13(14)15-12)8-16-10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3/t11-,12-/m0/s1 |
| InChIKey |
HONFLTYQACIYHN-RYUDHWBXSA-N |
| Molecular Weight |
236.329 g/mol |
| SMILES |
C1([C@@](CSc2ccccc2)([C@@](O1)(C(C)C)[H])[H])=O |
| SPLASH |
splash10-0a59-9300000000-c68d2e814b2de98e154a |
| Source of Spectrum |
J-56-5784-7 |
| Synonyms |
(3S,4S)-4-isopropyl-3-[(phenylsulfanyl)methyl]-2-oxetanone
(3S,4S)-3-[(phenylthio)methyl]-4-propan-2-yl-2-oxetanone
(3S,4S)-3-(phenylsulfanylmethyl)-4-propan-2-yloxetan-2-one
(3S,4S)-4-isopropyl-3-(phenylsulfanylmethyl)oxetan-2-one
(3S,4S)-3-(phenylsulfanylmethyl)-4-propan-2-yl-oxetan-2-one |
| Wiley ID |
1237990 |
![trans-4-(1-Methylethyl)-3-[(phenylthio)methyl]-1-oxetan-2-one](/api/spectrum/90tiB3ePyet/structure.png?h=300&w=458 "trans-4-(1-Methylethyl)-3-[(phenylthio)methyl]-1-oxetan-2-one")
