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5,7-Dichloro-1,2,3,4,4A,9A-hexahydro-4A-(1-pyrrolidinyl)xanthen-9-ol

View entire compound with spectra: 1 FTIR, and 1 Raman

5,7-Dichloro-1,2,3,4,4A,9A-hexahydro-4A-(1-pyrrolidinyl)xanthen-9-ol
SpectraBase Compound ID 5GeUo8YFp3O
InChI InChI=1S/C17H21Cl2NO2/c18-11-9-12-15(21)13-5-1-2-6-17(13,20-7-3-4-8-20)22-16(12)14(19)10-11/h9-10,13,15,21H,1-8H2
InChIKey WLUNTGWRRIECID-UHFFFAOYSA-N
Mol Weight 342.27 g/mol
Molecular Formula C17H21Cl2NO2
Exact Mass 341.094934 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 9ThULFL3aWz
Name 5,7-Dichloro-1,2,3,4,4A,9A-hexahydro-4A-(1-pyrrolidinyl)xanthen-9-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 341.094934318 u
Formula C17H21Cl2NO2
InChI InChI=1S/C17H21Cl2NO2/c18-11-9-12-15(21)13-5-1-2-6-17(13,20-7-3-4-8-20)22-16(12)14(19)10-11/h9-10,13,15,21H,1-8H2
InChIKey WLUNTGWRRIECID-UHFFFAOYSA-N
Molecular Weight 342.266 g/mol
SMILES OC1C2C(OC3=C1C=C(C=C3Cl)Cl)(CCCC2)N1CCCC1
Spectrum/Structure Validation Score (Raman) 0.940209