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1-(3-Butanoylaminopropyl)-2-(2-methoxy-6-methylbenzoylmethylene)pyrrolidine (o-methyldinorperipentadenine)
SpectraBase Compound ID HEISOYIAx9P
InChI InChI=1S/C21H32N2O3/c1-4-8-20(25)22-12-7-14-23-13-6-10-17(23)15-18(24)21-16(2)9-5-11-19(21)26-3/h5,9,11,17H,4,6-8,10,12-15H2,1-3H3,(H,22,25)
InChIKey ROCCDFQVMSAIDM-UHFFFAOYSA-N
Mol Weight 360.5 g/mol
Molecular Formula C21H32N2O3
Exact Mass 360.241293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IafH0QlEfYU
Name 1-(3-Butanoylaminopropyl)-2-(2-methoxy-6-methylbenzoylmethylene)pyrrolidine (O-methyldinorperipentadenine)
CAS Registry Number 100595-85-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32N2O3
InChI InChI=1S/C21H32N2O3/c1-4-8-20(25)22-12-7-14-23-13-6-10-17(23)15-18(24)21-16(2)9-5-11-19(21)26-3/h5,9,11,17H,4,6-8,10,12-15H2,1-3H3,(H,22,25)
InChIKey ROCCDFQVMSAIDM-UHFFFAOYSA-N
Molecular Weight 360.498 g/mol
SMILES N(C(=O)CCC)CCCN1C(CC(c2c(OC)cccc2C)=O)CCC1
SPLASH splash10-002b-1900000000-ff34518b20d125cc3bd9
Source of Spectrum F-52-2212-10
Synonyms Butanamide, N-[3-[2-[2-(2-methoxy-6-methylphenyl)-2-oxoethyl]-1-pyrrolidinyl]propyl]-, (.+-.)- N-(3-{2-[2-(2-methoxy-6-methylphenyl)-2-oxoethyl]-1-pyrrolidinyl}propyl)butanamide O-methyldinorperipentadenine
Wiley ID 795093