(1,3-Dimethyl-1H-pyrazol-5-yl){(6R)-6-[(6-methyl-2-pyridinyl)oxy]-1,4-oxazepan-4-yl}methanone
11440
Reference
(1,3-Dimethyl-1H-pyrazol-5-yl){(6R)-6-[(6-methyl-2-pyridinyl)oxy]-1,4-oxazepan-4-yl}methanone Structure
Systematic / IUPAC Name: (2,5-Dimethylpyrazol-3-yl)-[(6R)-6-(6-methylpyridin-2-yl)oxy-1,4-oxazepan-4-yl]methanone
ID: Reference11440
Other Names: NAT47-546961
Formula: C17H22N4O3
Spectral Data
(1,3-Dimethyl-1H-pyrazol-5-yl){(6R)-6-[(6-methyl-2-pyridinyl)oxy]-1,4-oxazepan-4-yl}methanone 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 | 899 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 6/3/2022 2:58:17 PM |
Identificators
| InChI | InChI=1S/C17H22N4O3/c1-12-5-4-6-16(18-12)24-14-10-21(7-8-23-11-14)17(22)15-9-13(2)19-20(15)3/h4-6,9,14H,7-8,10-11H2,1-3H3/t14-/m1/s1 |
| InChI Key | LHLLWUXSERGLPV-CQSZACIVSA-N |
| Canonical SMILES | CC1=NC(=CC=C1)OC2CN(CCOC2)C(=O)C3=CC(=NN3C)C |
| CAS | |
| Splash | |
| Other Names | NAT47-546961 |