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4-Methyl-4-benzylisochroman

View entire compound with spectra: 1 MS (GC)

4-Methyl-4-benzylisochroman
SpectraBase Compound ID HQdFtP48N9o
InChI InChI=1S/C17H18O/c1-17(11-14-7-3-2-4-8-14)13-18-12-15-9-5-6-10-16(15)17/h2-10H,11-13H2,1H3
InChIKey MDHDTTDAHCWTMR-UHFFFAOYSA-N
Mol Weight 238.33 g/mol
Molecular Formula C17H18O
Exact Mass 238.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lfjpLBKPXf
Name 4-Methyl-4-benzylisochroman
Alternate Name(s) 4-Benzyl-4-methyl-3,4-dihydro-1H-2-benzopyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O
InChI InChI=1S/C17H18O/c1-17(11-14-7-3-2-4-8-14)13-18-12-15-9-5-6-10-16(15)17/h2-10H,11-13H2,1H3
InChIKey MDHDTTDAHCWTMR-UHFFFAOYSA-N
Molecular Weight 238.330 g/mol
SMILES C1(c2c(cccc2)COC1)(Cc1ccccc1)C
SPLASH splash10-00ke-2900000000-46e43855b4975994aa4e
Source of Spectrum F-53-11820-23
Wiley ID 803380