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1-(o-Tolyl)adamantane
SpectraBase Compound ID Ljom8HQqPzF
InChI InChI=1S/C17H22/c1-12-4-2-3-5-16(12)17-9-13-6-14(10-17)8-15(7-13)11-17/h2-5,13-15H,6-11H2,1H3
InChIKey WVOPSKXMUDUNBF-UHFFFAOYSA-N
Mol Weight 226.36 g/mol
Molecular Formula C17H22
Exact Mass 226.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1NTFKMaVxw
Name 1-(2-Methylphenyl)adamantane
CAS Registry Number 61051-34-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22
InChI InChI=1S/C17H22/c1-12-4-2-3-5-16(12)17-9-13-6-14(10-17)8-15(7-13)11-17/h2-5,13-15H,6-11H2,1H3
InChIKey WVOPSKXMUDUNBF-UHFFFAOYSA-N
Molecular Weight 226.363 g/mol
SMILES C12(c3c(C)cccc3)CC3CC(C1)CC(C2)C3
SPLASH splash10-000l-6900000000-ef04aa0a92928c30eae2
Source of Spectrum J-55-1522-0
Wiley ID 1228294