| SpectraBase Spectrum ID |
8O8fqLd8c09 |
| Name |
(Z)-{5-isobutyryl-6-[(methylsulfanyl)carbonyl]bicyclo[2.2.1]hept-2-en-7-ylidene}methyl acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20O4S |
| InChI |
InChI=1S/C16H20O4S/c1-8(2)15(18)13-10-5-6-11(14(13)16(19)21-4)12(10)7-20-9(3)17/h5-8,10-11,13-14H,1-4H3/b12-7-/t10-,11+,13-,14-/m0/s1 |
| InChIKey |
UPCUGGHBYJPHNX-GHXNOFRVSA-N |
| Molecular Weight |
308.392 g/mol |
| SMILES |
[C@]12(\C([C@]([C@@]([C@]2(C(=O)C(C)C)[H])(C(=O)SC)[H])(C=C1)[H])=C\OC(=O)C)[H] |
| SPLASH |
splash10-03di-0091000000-430746d636fe87c76402 |
| Source of Spectrum |
F-53-17661-12 |
| Synonyms |
5-(Isopropylcarbonyl)-6-methyl-thio-carbonyl-7-acetoxymethylenebicyclo[2.2.1]hept-2-ene
6-(Isopropylcarbonyl)-6-methylthiocarbonyl-7-acetoxymethylenecyclo[2.2.1]hept-2-ene |
| Wiley ID |
805028 |
![(Z)-{5-isobutyryl-6-[(methylsulfanyl)carbonyl]bicyclo[2.2.1]hept-2-en-7-ylidene}methyl acetate](/api/spectrum/8O8fqLd8c09/structure.png?h=300&w=458 "(Z)-{5-isobutyryl-6-[(methylsulfanyl)carbonyl]bicyclo[2.2.1]hept-2-en-7-ylidene}methyl acetate")
