(2S)-2-[(4S,4aS,5S,8aS)-5-Hydroxy-4,8a-dimethyl-2-(methylamino)-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-6-yl]-N-(2-methoxyethyl)propanamide

enlarge

Systematic / IUPAC Name: (2S)-2-[(4S,4aS,5S,8aS)-5-Hydroxy-4,8a-dimethyl-2-(methylamino)-4a,5,6,7,8,9-hexahydro-4H-benzo[f][1,3]benzothiazol-6-yl]-N-(2-methoxyethyl)propanamide

ID: Reference12378

Other Names: NAT5-256952

Formula: C20H33N3O3S

Spectral Data

(2S)-2-[(4S,4aS,5S,8aS)-5-Hydroxy-4,8a-dimethyl-2-(methylamino)-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-6-yl]-N-(2-methoxyethyl)propanamide 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 914
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/17/2023 2:45:05 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C20H33N3O3S/c1-11(18(25)22-8-9-26-5)13-6-7-20(3)10-14-16(23-19(21-4)27-14)12(2)15(20)17(13)24/h11-13,15,17,24H,6-10H2,1-5H3,(H,21,23)(H,22,25)/t11-,12-,13?,15+,17-,20-/m0/s1
InChI Key ARVQUMBPTQUCAY-WFPOUMAHSA-N
Canonical SMILES CC1C2C(C(CCC2(CC3=C1N=C(S3)NC)C)C(C)C(=O)NCCOC)O
CAS
Splash
Other Names NAT5-256952

In Other Databases

PubChem 44716627
ChemSpider 21383801