| SpectraBase Spectrum ID |
JHT4Xmqn9rE |
| Name |
Triheptylamine |
| CAS Registry Number |
2411-36-1 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
311.355200453 u |
| Formula |
C21H45N |
| InChI |
InChI=1S/C21H45N/c1-4-7-10-13-16-19-22(20-17-14-11-8-5-2)21-18-15-12-9-6-3/h4-21H2,1-3H3 |
| InChIKey |
CLZGJKHEVKJLLS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
311.598 g/mol |
| Nominal Mass |
311 u |
| Quality |
989 |
| Retention Index |
2008 |
| SMILES |
C(N(CCCCCCC)CCCCCCC)CCCCCC |
| SPLASH |
splash10-004i-2190000000-010fbdb0524ba5d79064 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N,N-Diheptyl-1-heptanamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004637 |
