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2H-1-Benzopyran-2-one, 4-butyl-3,4-dihydro-6-methyl-
SpectraBase Compound ID 2ELGEErvUMb
InChI InChI=1S/C14H18O2/c1-3-4-5-11-9-14(15)16-13-7-6-10(2)8-12(11)13/h6-8,11H,3-5,9H2,1-2H3
InChIKey ADIVNBVXCMBLNV-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qBudc0Euu
Name 2H-1-Benzopyran-2-one, 4-butyl-3,4-dihydro-6-methyl-
Alternate Name(s) 4-Butyl-6-methyl-2-chromanone 4-Butyl-6-methyl-3,4-dihydrocoumarin
CAS Registry Number 90778-39-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-3-4-5-11-9-14(15)16-13-7-6-10(2)8-12(11)13/h6-8,11H,3-5,9H2,1-2H3
InChIKey ADIVNBVXCMBLNV-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES c12OC(CC(c2cc(cc1)C)CCCC)=O
SPLASH splash10-03r0-9920000000-2edd5ee8c0a30a494174
Source of Spectrum F-40-870-0
Wiley ID 1217926