| SpectraBase Spectrum ID |
LKQVJ1FsLB1 |
| Name |
(3R)-3-iodooctane |
| Appearance |
Pale pink oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.037495547 u |
| Formula |
C8H17I |
| InChI |
InChI=1S/C8H17I/c1-3-5-6-7-8(9)4-2/h8H,3-7H2,1-2H3/t8-/m1/s1 |
| InChIKey |
BXXIZBUOSKNJRM-MRVPVSSYSA-N |
| Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201800792 |
| Molecular Weight |
240.128 g/mol |
| Optical Rotation |
[a]D23= -23.4 (c = 0.27, CHCl3) |
| Quality |
192 |
| Reported Formula |
C8H17I |
| SMILES |
[C@@](I)(CCCCC)(CC)[H] |
| SPLASH |
splash10-01ox-9300000000-84cc99e31eda73d7105b |
| Source of Spectrum |
ACI-57-SM16-R-4b (DOI: 10.1002/anie.201800792) |
| Wiley ID |
1890737 |
