Systematic / IUPAC Name: 3-[(4R,7S,8aS)-7-[(4-Methoxyphenyl)methylamino]-1-oxo-3,4,6,7,8,8a-hexahydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]-N-[(4-methoxyphenyl)methyl]propanamide
ID: Reference12451
Other Names: NAT23-379467
Formula: C26H34N4O4
N-(4-Methoxybenzyl)-3-{(4R,7S,8aS)-7-[(4-methoxybenzyl)amino]-1-oxooctahydropyrrolo[1,2-a]pyrazin-4-yl}propanamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 2017 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 4/17/2023 10:42:32 AM |
InChI | InChI=1S/C26H34N4O4/c1-33-22-8-3-18(4-9-22)14-27-20-13-24-26(32)29-16-21(30(24)17-20)7-12-25(31)28-15-19-5-10-23(34-2)11-6-19/h3-6,8-11,20-21,24,27H,7,12-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,21+,24-/m0/s1 |
InChI Key | UBOZSOMXHRSTHH-IMSXRSKXSA-N |
Canonical SMILES | COC1=CC=C(C=C1)CNC2CC3C(=O)NCC(N3C2)CCC(=O)NCC4=CC=C(C=C4)OC |
CAS | |
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Other Names | NAT23-379467 |