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Pyrrolo[1,2-a]pyrazine-1,4-dione, 3-[(5,6-dihydro-6,6-dimethyl-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)methyl]hexahydro-, (3S-trans)-
SpectraBase Compound ID E2SkqlHGkOQ
InChI InChI=1S/C21H25N3O2/c1-21(2)8-10-23-12-13(14-5-3-6-15(21)18(14)23)11-16-20(26)24-9-4-7-17(24)19(25)22-16/h3,5-6,12,16-17H,4,7-11H2,1-2H3,(H,22,25)/t16-,17-/m0/s1
InChIKey SOWKUXVQDPHBPX-IRXDYDNUSA-N
Mol Weight 351.45 g/mol
Molecular Formula C21H25N3O2
Exact Mass 351.194677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhsoAlWOLdF
Name Pyrrolo[1,2-a]pyrazine-1,4-dione, 3-[(5,6-dihydro-6,6-dimethyl-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)methyl]hexahydro-, (3S-trans)-
Alternate Name(s) (3S,8aS)-3-[(6,6-dimethyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)methyl]hexahydropyrrolo[1,2-a]pyrazine-1,4-dione 4H-pyrrolo[3,2,1-ij]quinoline, pyrrolo[1,2-a]pyrazine-1,4-dione deriv. Cyclo-L-prolyl-L-1,7-(3,3-dimethylpropano)tryptophyl
CAS Registry Number 73093-50-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N3O2
InChI InChI=1S/C21H25N3O2/c1-21(2)8-10-23-12-13(14-5-3-6-15(21)18(14)23)11-16-20(26)24-9-4-7-17(24)19(25)22-16/h3,5-6,12,16-17H,4,7-11H2,1-2H3,(H,22,25)/t16-,17-/m0/s1
InChIKey SOWKUXVQDPHBPX-IRXDYDNUSA-N
Molecular Weight 351.450 g/mol
SMILES N1[C@](C(N2CCC[C@]2(C1=O)[H])=O)(Cc1c[n]2c3c1cccc3C(CC2)(C)C)[H]
SPLASH splash10-052b-7902000000-d9e37751dde0d81688a9
Source of Spectrum KC-1979-3057-0
Wiley ID 1342709