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6-Amino-3-butyl-5-(hexahydro-2,5-methanopentalene-3a-yl)carboxamido-1-(3-hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine

View entire compound with spectra: 1 MS (GC)

6-Amino-3-butyl-5-(hexahydro-2,5-methanopentalene-3a-yl)carboxamido-1-(3-hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine
SpectraBase Compound ID G8cEp0O2LJI
InChI InChI=1S/C21H32N4O4/c1-2-3-5-25-18(27)16(17(22)24(20(25)29)6-4-7-26)23-19(28)21-11-13-8-14(12-21)10-15(21)9-13/h13-15,26H,2-12,22H2,1H3,(H,23,28)/t13-,14+,15?,21?
InChIKey VQNYAUSGANPVPP-RPGRIMGWSA-N
Mol Weight 404.5 g/mol
Molecular Formula C21H32N4O4
Exact Mass 404.242356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YK8m8a0XOD
Name 6-Amino-3-butyl-5-(hexahydro-2,5-methanopentalene-3a-yl)carboxamido-1-(3-hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32N4O4
InChI InChI=1S/C21H32N4O4/c1-2-3-5-25-18(27)16(17(22)24(20(25)29)6-4-7-26)23-19(28)21-11-13-8-14(12-21)10-15(21)9-13/h13-15,26H,2-12,22H2,1H3,(H,23,28)/t13-,14+,15?,21?
InChIKey VQNYAUSGANPVPP-RPGRIMGWSA-N
Molecular Weight 404.511 g/mol
SMILES OCCCN1C(=C(C(N(C1=O)CCCC)=O)NC(C12C3C[C@](C2)(C[C@](C1)(C3)[H])[H])=O)N
SPLASH splash10-00di-0931300000-bd72d510a2ec202b4a5c
Source of Spectrum F-59-51-3e
Wiley ID 1676657