Systematic / IUPAC Name: N-[(1R,2S,3R,5R)-2,3-Dihydroxy-5-(4-methoxyphenyl)cyclopentyl]-1-benzothiophene-2-carboxamide
ID: Reference10901
Other Names:
Benzo[b]thiophene-2-carboxamide, N-[(1R,2S,3R,5R)-2,3-dihydroxy-5-(4-methoxyphenyl)cyclopentyl]-;
NAT38-538918
Formula: C21H21NO4S
N-[(1R,2S,3R,5R)-2,3-Dihydroxy-5-(4-methoxyphenyl)cyclopentyl]-1-benzothiophene-2-carboxamide 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 |
No. of Spectral Trees | 1 |
No. of Spectra | 2338 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 10/1/2021 7:37:56 AM |
InChI | InChI=1S/C21H21NO4S/c1-26-14-8-6-12(7-9-14)15-11-16(23)20(24)19(15)22-21(25)18-10-13-4-2-3-5-17(13)27-18/h2-10,15-16,19-20,23-24H,11H2,1H3,(H,22,25)/t15-,16-,19-,20-/m1/s1 |
InChI Key | CHUNGXOXXUUVIM-XNFNUYLZSA-N |
Canonical SMILES | COC1=CC=C(C=C1)C2CC(C(C2NC(=O)C3=CC4=CC=CC=C4S3)O)O |
CAS | |
Splash | |
Other Names |
Benzo[b]thiophene-2-carboxamide, N-[(1R,2S,3R,5R)-2,3-dihydroxy-5-(4-methoxyphenyl)cyclopentyl]-; NAT38-538918 |