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5-(4-Methoxyphenyl)pyrrolo[2,1-d][1,5]benzothiazepin-4-ol N,N-dimethylcarbamate
SpectraBase Compound ID GuvLavVeuOX
InChI InChI=1S/C22H20N2O3S/c1-23(2)22(25)27-20-18-8-6-14-24(18)17-7-4-5-9-19(17)28-21(20)15-10-12-16(26-3)13-11-15/h4-14H,1-3H3
InChIKey RGAJIKNGJBAVQP-UHFFFAOYSA-N
Mol Weight 392.47 g/mol
Molecular Formula C22H20N2O3S
Exact Mass 392.119464 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID LVoUm7iiCkH
Name 5-(4-Methoxyphenyl)pyrrolo[2,1-d][1,5]benzothiazepin-4-ol N,N-dimethylcarbamate
Source of Sample Enzo Life Sciences
Catalog Number 550-113-M005
Lot Number L00816
Cell Type Capillary tube
Compound Type Pure
Copyright Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20N2O3S
InChI InChI=1S/C22H20N2O3S/c1-23(2)22(25)27-20-18-8-6-14-24(18)17-7-4-5-9-19(17)28-21(20)15-10-12-16(26-3)13-11-15/h4-14H,1-3H3
InChIKey RGAJIKNGJBAVQP-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 501 mW
Raman Laser Source Nd:YAG
SMILES c-12ccccc2S\C(=C/(c2[n]1ccc2)OC(N(C)C)=O)c1ccc(cc1)OC
Scans Performed 2112
Source of Spectrum Forensic Spectral Research
Synonyms NF51
Technique FT-Raman