N,N-Diethyl-2-[(16R,17S)-8-(4-morpholinyl)-2-oxo-12-oxa-1,4-diazatricyclo[14.3.1.06,11]icosa-6,8,10-trien-17-yl]acetamide
12868
Reference
N,N-Diethyl-2-[(16R,17S)-8-(4-morpholinyl)-2-oxo-12-oxa-1,4-diazatricyclo[14.3.1.06,11]icosa-6,8,10-trien-17-yl]acetamide Structure
Systematic / IUPAC Name: N,N-Diethyl-2-[(16R,17S)-8-morpholin-4-yl-2-oxo-12-oxa-1,4-diazatricyclo[14.3.1.06,11]icosa-6(11),7,9-trien-17-yl]acetamide
ID: Reference12868
Other Names: MC14-529351
Formula: C27H42N4O4
Spectral Data
N,N-Diethyl-2-[(16R,17S)-8-(4-morpholinyl)-2-oxo-12-oxa-1,4-diazatricyclo[14.3.1.06,11]icosa-6,8,10-trien-17-yl]acetamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 1745 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/9/2023 9:26:59 AM |
Identificators
| InChI | InChI=1S/C27H42N4O4/c1-3-29(4-2)26(32)17-21-9-10-31-20-22(21)6-5-13-35-25-8-7-24(30-11-14-34-15-12-30)16-23(25)18-28-19-27(31)33/h7-8,16,21-22,28H,3-6,9-15,17-20H2,1-2H3/t21-,22-/m0/s1 |
| InChI Key | IBEGDRZNUYGDBZ-VXKWHMMOSA-N |
| Canonical SMILES | CCN(CC)C(=O)CC1CCN2CC1CCCOC3=C(CNCC2=O)C=C(C=C3)N4CCOCC4 |
| CAS | |
| Splash | |
| Other Names | MC14-529351 |