| SpectraBase Compound ID | 5o2TDAc6o4h |
|---|---|
| InChI | InChI=1S/C18H26N2/c1-16(2)8-6-12-20-13-7-11-18(20)15-19-14-17-9-4-3-5-10-17/h3-5,8-10,15,18H,6-7,11-14H2,1-2H3/b19-15+/t18-/m0/s1/i3D,4D,5D,9D,10D,14D2 |
| InChIKey | QZZGWVZHTAOMBI-NTWKVVLASA-N |
| Mol Weight | 277.46 g/mol |
| Molecular Formula | C18H19D7N2 |
| Exact Mass | 277.253536 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BBkBX0ghMCN |
|---|---|
| Name | N-( 4-Methyl-3-pentenyl)-(S)-prolinal-(heptadeuterio)benzylamine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H19D7N2 |
| InChI | InChI=1S/C18H26N2/c1-16(2)8-6-12-20-13-7-11-18(20)15-19-14-17-9-4-3-5-10-17/h3-5,8-10,15,18H,6-7,11-14H2,1-2H3/b19-15+/t18-/m0/s1/i3D,4D,5D,9D,10D,14D2 |
| InChIKey | QZZGWVZHTAOMBI-NTWKVVLASA-N |
| Molecular Weight | 277.463 g/mol |
| SMILES | c1(c(c([D])c(c(c1[D])[D])[D])[D])C(\N=C\[C@]1(N(CCC=C(C)C)CCC1)[H])([D])[D] |
| SPLASH | splash10-0a4i-9340000000-e9944b88bed1944e08af |
| Source of Spectrum | K-127-2032-34 |
| Wiley ID | 1274881 |