Debug Info

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8vA6RVNFtsn
spectrumID
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8vA6RVNFtsn
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Methyl 3-benzyloxy-6-formyl-4-iodo-2-methoxybenzoate
SpectraBase Compound ID GjmCRksqrnW
InChI InChI=1S/C17H15IO5/c1-21-16-14(17(20)22-2)12(9-19)8-13(18)15(16)23-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3
InChIKey TYVDOMLVNYNIKC-UHFFFAOYSA-N
Mol Weight 426.21 g/mol
Molecular Formula C17H15IO5
Exact Mass 425.996419 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vA6RVNFtsn
Name Methyl 3-Benzyloxy-6-formyl-4-iodo-2-methoxybenzoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15IO5
InChI InChI=1S/C17H15IO5/c1-21-16-14(17(20)22-2)12(9-19)8-13(18)15(16)23-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3
InChIKey TYVDOMLVNYNIKC-UHFFFAOYSA-N
Molecular Weight 426.206 g/mol
SMILES C(c1c(c(c(cc1C=O)I)OCc1ccccc1)OC)(=O)OC
SPLASH splash10-0006-9000000000-75ebb1a2ef6d803ce2dd
Source of Spectrum F4-0-3577-18
Wiley ID 1619166
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