| SpectraBase Spectrum ID |
LdouxrNa4go |
| Name |
Ortho-D2-benzylcyanide |
| Alternate Name(s) |
2,6-D2-benzylcyanide
2,6-Dideutero-.alpha.-cyanotoluene |
| CAS Registry Number |
53897-46-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H5D2N |
| InChI |
InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2/i4D,5D |
| InChIKey |
SUSQOBVLVYHIEX-KFRNQKGQSA-N |
| Molecular Weight |
119.163 g/mol |
| SMILES |
C(#N)Cc1c(cccc1[D])[D] |
| SPLASH |
splash10-014i-9800000000-e25f5ac7810207097c9b |
| Source of Spectrum |
OS-5-270-0 |
| Wiley ID |
80770 |
