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O-methyl-ismine
SpectraBase Compound ID 5WZkEywEThz
InChI InChI=1S/C16H17NO3/c1-17-14-6-4-3-5-12(14)11-7-8-15-16(20-10-19-15)13(11)9-18-2/h3-8,17H,9-10H2,1-2H3
InChIKey YJKICIVUNPNWDQ-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C16H17NO3
Exact Mass 271.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QwmN8BRnIX
Name O-methyl-ismine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO3
InChI InChI=1S/C16H17NO3/c1-17-14-6-4-3-5-12(14)11-7-8-15-16(20-10-19-15)13(11)9-18-2/h3-8,17H,9-10H2,1-2H3
InChIKey YJKICIVUNPNWDQ-UHFFFAOYSA-N
Molecular Weight 271.316 g/mol
SMILES N(c1c(-c2c(c3c(OCO3)cc2)COC)cccc1)C
SPLASH splash10-00di-0290000000-293e9cc778a3291b8901
Source of Spectrum G4-64-841-3
Synonyms 2-[(3',4'-Methylenedioxy)-2'-(methoxymethyl)phenyl]-N-methylaniline 2-[4-(methoxymethyl)-1,3-benzodioxol-5-yl]-N-methylaniline N-{2-[4-(methoxymethyl)-1,3-benzodioxol-5-yl]phenyl}-N-methylamine
Wiley ID 1609039