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Methyl 3-cyclohexylindene-2(13C)-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl 3-cyclohexylindene-2(13C)-carboxylate
SpectraBase Compound ID L8izfdl0ztk
InChI InChI=1S/C17H20O2/c1-19-17(18)15-11-13-9-5-6-10-14(13)16(15)12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3/i17+1
InChIKey FCYHNCRFJHQLST-CAAGJAQSSA-N
Mol Weight 257.34 g/mol
Molecular Formula C1613CH20O2
Exact Mass 257.149685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9lkVxgdCkm2
Name Methyl 3-cyclohexylindene-2(13C)-carboxylate
Comments Original formula: C16[13C]H20O2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O2
InChI InChI=1S/C17H20O2/c1-19-17(18)15-11-13-9-5-6-10-14(13)16(15)12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3/i17+1
InChIKey FCYHNCRFJHQLST-CAAGJAQSSA-N
Molecular Weight 257.337 g/mol
SMILES C1(=C(c2ccccc2C1)C1CCCCC1)[13C](=O)OC
SPLASH splash10-00fr-0900000000-8821e622b4192b43b24f
Source of Spectrum K-127-555-13
Wiley ID 1260304