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Bicyclo[4.2.0]octa-1,3,5-triene-3-methanol, 2-iodo-
SpectraBase Compound ID BbdgibhbzbT
InChI InChI=1S/C9H9IO/c10-9-7(5-11)2-1-6-3-4-8(6)9/h1-2,11H,3-5H2
InChIKey OTOCHSKWRHGHSY-UHFFFAOYSA-N
Mol Weight 260.07 g/mol
Molecular Formula C9H9IO
Exact Mass 259.96981 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QXqxqjBjLz
Name Bicyclo[4.2.0]octa-1,3,5-triene-3-methanol, 2-iodo-
Alternate Name(s) (2-iodobicyclo[4.2.0]octa-1,3,5-trien-3-yl)methanol 3-iodo-4-hydroxymethylbenzocyclobutene
CAS Registry Number 77130-55-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9IO
InChI InChI=1S/C9H9IO/c10-9-7(5-11)2-1-6-3-4-8(6)9/h1-2,11H,3-5H2
InChIKey OTOCHSKWRHGHSY-UHFFFAOYSA-N
Molecular Weight 260.074 g/mol
SMILES OCc1c(c2CCc2cc1)I
SPLASH splash10-00kf-0590000000-0453799ff8ef57062353
Source of Spectrum F-36-2438-0
Wiley ID 1263090