N-Benzyl-3-[(4R,7S,8aS)-7-{[4-(dimethylamino)benzyl]amino}-1-oxooctahydropyrrolo[1,2-a]pyrazin-4-yl]propanamide

enlarge

Systematic / IUPAC Name: 3-[(4R,7S,8aS)-7-[[4-(Dimethylamino)phenyl]methylamino]-1-oxo-3,4,6,7,8,8a-hexahydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]-N-benzylpropanamide

ID: Reference12683

Other Names: NAT23-379534

Formula: C26H35N5O2

Spectral Data

N-Benzyl-3-[(4R,7S,8aS)-7-{[4-(dimethylamino)benzyl]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.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 400
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 7/28/2023 6:55:31 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C26H35N5O2/c1-30(2)22-10-8-20(9-11-22)15-27-21-14-24-26(33)29-17-23(31(24)18-21)12-13-25(32)28-16-19-6-4-3-5-7-19/h3-11,21,23-24,27H,12-18H2,1-2H3,(H,28,32)(H,29,33)/t21-,23+,24-/m0/s1
InChI Key CHBOWHUEOFFEQC-QTJGBDASSA-N
Canonical SMILES CN(C)C1=CC=C(C=C1)CNC2CC3C(=O)NCC(N3C2)CCC(=O)NCC4=CC=CC=C4
CAS
Splash
Other Names NAT23-379534

In Other Databases

PubChem 45360674
ChemSpider 21382575