| SpectraBase Spectrum ID |
7bIhyAF4HkY |
| Name |
Isopropyl chlorohaematommate |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13ClO5 |
| InChI |
InChI=1S/C12H13ClO5/c1-5(2)18-12(17)8-6(3)9(13)11(16)7(4-14)10(8)15/h4-5,15-16H,1-3H3 |
| InChIKey |
NKIVWTXLVQIYGX-UHFFFAOYSA-N |
| Instrument Name |
Agilent 7890A-5975C and Agilent-7693 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ffj.3578 |
| Molecular Weight |
272.684 g/mol |
| SMILES |
Oc1c(c(c(c(c1Cl)C)C(OC(C)C)=O)O)C=O |
| SPLASH |
splash10-001i-2950000000-d2d431db2a48e51be490 |
| Source of Spectrum |
10.1002/ffj.3578 |
| Wiley ID |
1856255 |
