(6R)-4-[(1-Methyl-1H-imidazol-2-yl)methyl]-6-[4-(methylsulfonyl)phenoxy]-1,4-oxazepane

enlarge

Systematic / IUPAC Name: (6R)-4-[(1-Methylimidazol-2-yl)methyl]-6-(4-methylsulfonylphenoxy)-1,4-oxazepane

ID: Reference11384

Other Names: NAT47-552481

Formula: C17H23N3O4S

Spectral Data

(6R)-4-[(1-Methyl-1H-imidazol-2-yl)methyl]-6-[4-(methylsulfonyl)phenoxy]-1,4-oxazepane mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 155
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 5/5/2022 2:31:19 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C17H23N3O4S/c1-19-8-7-18-17(19)12-20-9-10-23-13-15(11-20)24-14-3-5-16(6-4-14)25(2,21)22/h3-8,15H,9-13H2,1-2H3/t15-/m1/s1
InChI Key NIYFGACWKUSGCT-OAHLLOKOSA-N
Canonical SMILES CN1C=CN=C1CN2CCOCC(C2)OC3=CC=C(C=C3)S(=O)(=O)C
CAS
Splash
Other Names NAT47-552481

In Other Databases

ChemSpider 29855549
PubChem 75536923