| SpectraBase Spectrum ID |
FeIOoUcAA1O |
| Name |
7-Acetoxymethyene-5-.alpha.(-methylthio)acetyl-3-butyl-2-oxacyclo[4.3.0]nona-3,8-diene |
| Alternate Name(s) |
(Z)-((4S)-2-butyl-4-[(methylsulfanyl)carbonyl]-4a,7a-dihydrocyclopenta[b]pyran-5(4H)-ylidene)methyl acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22O4S |
| InChI |
InChI=1S/C17H22O4S/c1-4-5-6-13-9-14(17(19)22-3)16-12(10-20-11(2)18)7-8-15(16)21-13/h7-10,14-16H,4-6H2,1-3H3/b12-10-/t14-,15?,16?/m1/s1 |
| InChIKey |
WXOUGJBPQMKMLY-NKRRQIQCSA-N |
| Molecular Weight |
322.419 g/mol |
| SMILES |
[C@]1(C2C(C=C\C2=C/OC(=O)C)OC(=C1)CCCC)(C(=O)SC)[H] |
| SPLASH |
splash10-004i-0091000000-10c9936eb7d40f23c250 |
| Source of Spectrum |
F-53-17662-13 |
| Wiley ID |
805025 |
![7-Acetoxymethyene-5-.alpha.(-methylthio)acetyl-3-butyl-2-oxacyclo[4.3.0]nona-3,8-diene](/api/spectrum/FeIOoUcAA1O/structure.png?h=300&w=458 "7-Acetoxymethyene-5-.alpha.(-methylthio)acetyl-3-butyl-2-oxacyclo[4.3.0]nona-3,8-diene")
