| SpectraBase Spectrum ID |
51anpdT96 |
| Name |
3-Chlorobenzoic-2,6-d2 acid |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H3D2ClO2 |
| InChI |
InChI=1S/C7H5ClO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)/i2D,4D |
| InChIKey |
LULAYUGMBFYYEX-XRIVEGAOSA-N |
| Instrument Name |
Jeol AccuTOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/cctc.201902051 |
| Molecular Weight |
158.580 g/mol |
| Reported Formula |
C7H3D2(35)ClO2 |
| SMILES |
OC(c1c([D])ccc(c1[D])Cl)=O |
| SPLASH |
splash10-0btc-0900000000-7ffb842ef83a0160ca44 |
| Source of Spectrum |
CCC-12-SM17-[D]2-1k, [D]1-1k |
| Wiley ID |
1839789 |
