| SpectraBase Spectrum ID |
HLzdkkuvsmX |
| Name |
3-Hexen-3-ol, 4-iodo-, acetate, (E)- |
| CAS Registry Number |
112701-53-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H13IO2 |
| InChI |
InChI=1S/C8H13IO2/c1-4-7(9)8(5-2)11-6(3)10/h4-5H2,1-3H3/b8-7+ |
| InChIKey |
ORWTVLAINCUJBP-BQYQJAHWSA-N |
| Molecular Weight |
268.094 g/mol |
| SMILES |
C(O\C(=C/(I)CC)CC)(=O)C |
| SPLASH |
splash10-004i-0090000000-c3aeadb2f627c2063d70 |
| Source of Spectrum |
KC-1987-1018-2 |
| Synonyms |
(1E)-1-ethyl-2-iodo-1-butenyl acetate
(E)-1-Ethyl-2-iodobut-1-enyl acetate |
| Wiley ID |
1271530 |
