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2-iodo-1-[(1S)-1-methoxyethyl]-3-(methoxymethoxy)benzene
SpectraBase Compound ID LDVHwfdCCBk
InChI InChI=1S/C11H15IO3/c1-8(14-3)9-5-4-6-10(11(9)12)15-7-13-2/h4-6,8H,7H2,1-3H3/t8-/m0/s1
InChIKey CSIRWVNOJDKNAR-QMMMGPOBSA-N
Mol Weight 322.14 g/mol
Molecular Formula C11H15IO3
Exact Mass 322.006589 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KfPPicnQFaj
Name 2-Iodo-1-[(1S)-1-methoxyethyl]-3-(methoxymethoxy)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.006589340 u
Formula C11H15IO3
InChI InChI=1S/C11H15IO3/c1-8(14-3)9-5-4-6-10(11(9)12)15-7-13-2/h4-6,8H,7H2,1-3H3/t8-/m0/s1
InChIKey CSIRWVNOJDKNAR-QMMMGPOBSA-N
Molecular Weight 322.142 g/mol
SMILES C=1(C(=C(OCOC)C=CC1)I)[C@@](OC)(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.822285