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2-Allyl-6-iodo-benzoic acid
SpectraBase Compound ID 6OynB3J9NhI
InChI InChI=1S/C10H9IO2/c1-2-4-7-5-3-6-8(11)9(7)10(12)13/h2-3,5-6H,1,4H2,(H,12,13)
InChIKey QKYWNMJFIMLPCG-UHFFFAOYSA-N
Mol Weight 288.08 g/mol
Molecular Formula C10H9IO2
Exact Mass 287.964725 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7xPfYqL0K3n
Name 2-Allyl-6-iodo-benzoic acid
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 287.964724528 u
Formula C10H9IO2
InChI InChI=1S/C10H9IO2/c1-2-4-7-5-3-6-8(11)9(7)10(12)13/h2-3,5-6H,1,4H2,(H,12,13)
InChIKey QKYWNMJFIMLPCG-UHFFFAOYSA-N
Instrument Name Waters GCT Premier CAB163
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/anie.201712520
Molecular Weight 288.084 g/mol
Quality 173
Reported Formula C10H9O2I
SMILES OC(C1=C(CC=C)C=CC=C1I)=O
SPLASH splash10-01b9-0690000000-8bb1675496b635ff5a64
Source of Spectrum ACI-57-SM9-3ea (DOI: 10.1002/anie.201712520)
Wiley ID 1893523