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2-Octanone, 1-[[(3-hydroxy-4-methoxyphenyl)methyl]methylamino]-1-phenyl-
SpectraBase Compound ID 8Ag3FxtJCOB
InChI InChI=1S/C23H31NO3/c1-4-5-6-10-13-20(25)23(19-11-8-7-9-12-19)24(2)17-18-14-15-22(27-3)21(26)16-18/h7-9,11-12,14-16,23,26H,4-6,10,13,17H2,1-3H3
InChIKey BSQAYDBLQIIBHR-UHFFFAOYSA-N
Mol Weight 369.51 g/mol
Molecular Formula C23H31NO3
Exact Mass 369.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66qiIz4NhMV
Name 2-Octanone, 1-[[(3-hydroxy-4-methoxyphenyl)methyl]methylamino]-1-phenyl-
CAS Registry Number 99365-53-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H31NO3
InChI InChI=1S/C23H31NO3/c1-4-5-6-10-13-20(25)23(19-11-8-7-9-12-19)24(2)17-18-14-15-22(27-3)21(26)16-18/h7-9,11-12,14-16,23,26H,4-6,10,13,17H2,1-3H3
InChIKey BSQAYDBLQIIBHR-UHFFFAOYSA-N
Molecular Weight 369.505 g/mol
SMILES Oc1cc(CN(C(C(=O)CCCCCC)c2ccccc2)C)ccc1OC
SPLASH splash10-00di-0900000000-b644e440e83d92f5f9d0
Source of Spectrum AJ-59-461-5
Synonyms 1-[(3-hydroxy-4-methoxybenzyl)(methyl)amino]-1-phenyl-2-octanone N-Methyl-N-(2-oxo-1-phenyloctyl)-3-hydroxy-4-methoxybenzylamine
Wiley ID 1353808