SpectraBase Compound ID | LWLBD5f01qj |
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InChI | InChI=1S/C21H44/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h3-21H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2,20D2,21D2 |
InChIKey | FNAZRRHPUDJQCJ-FQKBWVJWSA-N |
Mol Weight | 340.85 g/mol |
Molecular Formula | C212D44 |
Exact Mass | 340.620478 g/mol |
SpectraBase Spectrum ID | BgvNu9snDSq |
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Name | Perdeuterio-heneicosane |
CAS Registry Number | 39756-37-1 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21D44 |
InChI | InChI=1S/C21H44/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h3-21H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2,20D2,21D2 |
InChIKey | FNAZRRHPUDJQCJ-FQKBWVJWSA-N |
Molecular Weight | 340.851 g/mol |
SMILES | C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C([2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])(C([2D])([2D])[2D])([2D])[2D] |
SPLASH | splash10-0gc1-9100000000-19737e9d737495f535af |
Source of Spectrum | N-2-175-6 |
Synonyms | 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,21-Tetratetracontadeuteriohenicosane |
Wiley ID | 1299774 |