(6R)-4-(1,3-Benzothiazol-2-yl)-1,4-oxazepan-6-yl (4-methoxybenzyl)carbamate

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Systematic / IUPAC Name: [(6R)-4-(1,3-Benzothiazol-2-yl)-1,4-oxazepan-6-yl] N-[(4-methoxyphenyl)methyl]carbamate

ID: Reference12746

Other Names: NAT47-560501

Formula: C21H23N3O4S

Spectral Data

(6R)-4-(1,3-Benzothiazol-2-yl)-1,4-oxazepan-6-yl (4-methoxybenzyl)carbamate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1874
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/11/2023 12:55:44 PM
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Identificators

InChI InChI=1S/C21H23N3O4S/c1-26-16-8-6-15(7-9-16)12-22-21(25)28-17-13-24(10-11-27-14-17)20-23-18-4-2-3-5-19(18)29-20/h2-9,17H,10-14H2,1H3,(H,22,25)/t17-/m1/s1
InChI Key PXJYZNKFAOCIDG-QGZVFWFLSA-N
Canonical SMILES COC1=CC=C(C=C1)CNC(=O)OC2CN(CCOC2)C3=NC4=CC=CC=C4S3
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Other Names NAT47-560501

In Other Databases

ChemSpider 29855674
PubChem 75367767