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Palmarumycin C6

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Palmarumycin C6
SpectraBase Compound ID 5DdlmT9RIJN
InChI InChI=1S/C19H12O5/c20-11-7-8-12(21)18-17(11)13(22)9-19(18)23-14-5-1-3-10-4-2-6-15(24-19)16(10)14/h1-8,20-21H,9H2
InChIKey NLXZERAARWDGRG-UHFFFAOYSA-N
Mol Weight 320.3 g/mol
Molecular Formula C19H12O5
Exact Mass 320.068473 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1ewam6ioAEO
Name Palmarumycin C6
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.068473481 u
Formula C19H12O5
InChI InChI=1S/C19H12O5/c20-11-7-8-12(21)18-17(11)13(22)9-19(18)23-14-5-1-3-10-4-2-6-15(24-19)16(10)14/h1-8,20-21H,9H2
InChIKey NLXZERAARWDGRG-UHFFFAOYSA-N
Molecular Weight 320.300 g/mol
SMILES C12(C3=C(C(O)=CC=C3O)C(C1)=O)OC=1C3=C(C=CC=C3O2)C=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.832645