Systematic / IUPAC Name: 8-(4-Fluoroanilino)-3,5a,10-trimethyl-3,3a,4,5,6,10,10a,10b-octahydro-[1]benzofuro[7,6-f][1,3]benzothiazol-2-one
ID: Reference8961
Other Names:
Furo[3',2':7,8]naphtho[2,3-d]thiazol-2(3H)-one, 8-[(4-fluorophenyl)amino]-3a,4,5,5a,6,10,10a,10b-octahydro-3,5a,10-trimethyl-;
NAT5-247500
Formula: C22H25FN2O2S
8-[(4-Fluorophenyl)amino]-3,5a,10-trimethyl-3a,4,5,5a,6,10,10a,10b-octahydrofuro[3',2':7,8]naphtho[2,3-d][1,3]thiazol-2(3H)-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 1 |
No. of Spectra | 1281 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 9/26/2019 6:48:35 AM |
InChI | InChI=1S/C22H25FN2O2S/c1-11-15-8-9-22(3)10-16-18(12(2)17(22)19(15)27-20(11)26)25-21(28-16)24-14-6-4-13(23)5-7-14/h4-7,11-12,15,17,19H,8-10H2,1-3H3,(H,24,25) |
InChI Key | KLOVLUHONZMRDN-UHFFFAOYSA-N |
Canonical SMILES | CC1C2CCC3(CC4=C(C(C3C2OC1=O)C)N=C(S4)NC5=CC=C(C=C5)F)C |
CAS | |
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Other Names |
Furo[3',2':7,8]naphtho[2,3-d]thiazol-2(3H)-one, 8-[(4-fluorophenyl)amino]-3a,4,5,5a,6,10,10a,10b-octahydro-3,5a,10-trimethyl-; NAT5-247500 |