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2-Naphthalenecarbonitrile, 3,4-dihydro-8-methoxy-5-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-
SpectraBase Compound ID JVxoSvHCpUs
InChI InChI=1S/C18H21NO3/c1-18(21-9-10-22-18)8-7-14-4-6-17(20-2)16-11-13(12-19)3-5-15(14)16/h4,6,11H,3,5,7-10H2,1-2H3
InChIKey QSHMCXSMIJOCJS-UHFFFAOYSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99477GIAR1Y
Name 2-Naphthalenecarbonitrile, 3,4-dihydro-8-methoxy-5-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-
CAS Registry Number 80535-64-4
Comments Less than 3 mono-isotopic peaks
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Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-18(21-9-10-22-18)8-7-14-4-6-17(20-2)16-11-13(12-19)3-5-15(14)16/h4,6,11H,3,5,7-10H2,1-2H3
InChIKey QSHMCXSMIJOCJS-UHFFFAOYSA-N
Molecular Weight 299.370 g/mol
SMILES c12c(CCC(=C2)C#N)c(CCC2(OCCO2)C)ccc1OC
SPLASH splash10-000i-9010000000-f7ed7e8bab53f3b5c066
Source of Spectrum B-34-1894-0
Synonyms 8-Methoxy-5-[2'-(2''-methyl-1'',3''-dioxolan-2''-yl)ethyl]-1,2,3,4-tetrahydronaphthalene-2-carbonitrile 8-Methoxy-5-[2'-(2''-methyl-1'',3''-dioxolan-2''-yl)ethyl]-1,2,3,4-tetrahydronaphthalene-2-carbonitrile 8-methoxy-5-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2-naphthalenecarbonitrile
Wiley ID 1302132