| SpectraBase Spectrum ID |
3Tnk6ACxxVS |
| Name |
(2S,3R,4R)-2-Ethyl-4-(iodomethyl)-3-methyl-.gamma.-butyrolactone |
| Alternate Name(s) |
(3S,4R,5R)-3-ethyl-5-(iodomethyl)-4-methyldihydro-2(3H)-furanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H13IO2 |
| InChI |
InChI=1S/C8H13IO2/c1-3-6-5(2)7(4-9)11-8(6)10/h5-7H,3-4H2,1-2H3/t5-,6+,7+/m1/s1 |
| InChIKey |
FYRYJBRMQSUTCA-VQVTYTSYSA-N |
| Molecular Weight |
268.094 g/mol |
| SMILES |
C1(O[C@@](CI)([C@@]([C@@]1(CC)[H])(C)[H])[H])=O |
| SPLASH |
splash10-0a4i-9000000000-60fa4f9626b6ad1bd68c |
| Source of Spectrum |
J-62-4447-9 |
| Wiley ID |
1271539 |
