| SpectraBase Spectrum ID |
Bojgy6FKYYj |
| Name |
1,2,4,5-tetradeuterio-3,6-bis(trideuteriomethyl)benzene |
| Alternate Name(s) |
1,4-Di(methyl-d3)benzene-d4
Benzene-1,2,4,5-d4-, 3,6-di(methyl-d3)-
p-Xylene |
| CAS Registry Number |
41051-88-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8D10 |
| InChI |
InChI=1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3/i1D3,2D3,3D,4D,5D,6D |
| InChIKey |
URLKBWYHVLBVBO-ZGYYUIRESA-N |
| Molecular Weight |
116.229 g/mol |
| SMILES |
c1(c(c([D])c(c(c1[D])[D])C([D])([D])[D])[D])C([D])([D])[D] |
| SPLASH |
splash10-00kb-9600000000-79d13b7d5c9c15f56a3b |
| Source of Spectrum |
JC-628-87-0 |
| Wiley ID |
1121474 |
