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8-Hydroxyloxapine in kbr

View entire compound with spectra: 1 Raman

8-Hydroxyloxapine in kbr
SpectraBase Compound ID E79X0DrLa2L
InChI InChI=1S/C18H18ClN3O2/c1-21-6-8-22(9-7-21)18-14-10-12(19)2-4-16(14)24-17-5-3-13(23)11-15(17)20-18/h2-5,10-11,23H,6-9H2,1H3
InChIKey VNJRIWXLPIYFGI-UHFFFAOYSA-N
Mol Weight 343.81 g/mol
Molecular Formula C18H18ClN3O2
Exact Mass 343.108755 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID F6LnZX7pCzP
Name 8-Hydroxyloxapine in kbr
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.108754530 u
Formula C18H18ClN3O2
InChI InChI=1S/C18H18ClN3O2/c1-21-6-8-22(9-7-21)18-14-10-12(19)2-4-16(14)24-17-5-3-13(23)11-15(17)20-18/h2-5,10-11,23H,6-9H2,1H3
InChIKey VNJRIWXLPIYFGI-UHFFFAOYSA-N
Molecular Weight 343.814 g/mol
SMILES C=1(C=CC2=C(C1)N=C(C1=C(O2)C=CC(=C1)Cl)N1CCN(CC1)C)O
Spectrum/Structure Validation Score (Raman) 0.976595