| SpectraBase Compound ID | L9Ks32hap1P |
|---|---|
| InChI | InChI=1S/C16H19N3O/c1-19-8-10(16(17)20)5-12-11-3-2-4-13-15(11)9(7-18-13)6-14(12)19/h2-4,7,10,12,14,18H,5-6,8H2,1H3,(H2,17,20) |
| InChIKey | OEVHDXFBOKGRLN-UHFFFAOYSA-N |
| Mol Weight | 269.35 g/mol |
| Molecular Formula | C16H19N3O |
| Exact Mass | 269.152812 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 86MvsF7Kndh |
|---|---|
| Name | Dihydroergotamine - GC Artefact 04 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H19N3O |
| InChI | InChI=1S/C16H19N3O/c1-19-8-10(16(17)20)5-12-11-3-2-4-13-15(11)9(7-18-13)6-14(12)19/h2-4,7,10,12,14,18H,5-6,8H2,1H3,(H2,17,20) |
| InChIKey | OEVHDXFBOKGRLN-UHFFFAOYSA-N |
| Molecular Weight | 269.348 g/mol |
| SMILES | NC(C1CC2C(Cc3c4c([nH]c3)cccc24)N(C1)C)=O |
| SPLASH | splash10-014i-0890000000-61b7d999a8eff51e63c0 |
| Source of Spectrum | CJ-0-2-3580 |
| Wiley ID | 1273347 |