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N-Methylpavine
SpectraBase Compound ID Enc5QDkgVDf
InChI InChI=1S/C21H25NO4/c1-22-16-6-12-8-18(23-2)20(25-4)10-14(12)17(22)7-13-9-19(24-3)21(26-5)11-15(13)16/h8-11,16-17H,6-7H2,1-5H3/t16-,17-/m0/s1
InChIKey QEOWCPFWLCIQSL-IRXDYDNUSA-N
Mol Weight 355.43 g/mol
Molecular Formula C21H25NO4
Exact Mass 355.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GbA5kPJn9t
Name N-Methylpavine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO4
InChI InChI=1S/C21H25NO4/c1-22-16-6-12-8-18(23-2)20(25-4)10-14(12)17(22)7-13-9-19(24-3)21(26-5)11-15(13)16/h8-11,16-17H,6-7H2,1-5H3/t16-,17-/m0/s1
InChIKey QEOWCPFWLCIQSL-IRXDYDNUSA-N
Molecular Weight 355.434 g/mol
SMILES [C@@]12(N([C@@](Cc3cc(c(cc23)OC)OC)(c2c(cc(c(c2)OC)OC)C1)[H])C)[H]
SPLASH splash10-0udi-0092000000-daa6e682a0102fd64460
Source of Spectrum KC-0-911-13
Wiley ID 785352