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9-OXO-1,2,3,3A,4,9-HEXAHYDROPYRROLO-[2,1-B]-QUINAZOLINE-1-BENZYLCARBOXAMIDE
SpectraBase Compound ID 8XxY9xVrZRT
InChI InChI=1S/C19H19N3O2/c23-18(20-12-13-6-2-1-3-7-13)16-10-11-17-21-15-9-5-4-8-14(15)19(24)22(16)17/h1-9,16-17,21H,10-12H2,(H,20,23)/t16-,17+/m0/s1
InChIKey WJOHFIGPSODSIV-DLBZAZTESA-N
Mol Weight 321.38 g/mol
Molecular Formula C19H19N3O2
Exact Mass 321.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BcUx9JM99hw
Name (1S,3aR)-9-Oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-1-benzylcarboxamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19N3O2
InChI InChI=1S/C19H19N3O2/c23-18(20-12-13-6-2-1-3-7-13)16-10-11-17-21-15-9-5-4-8-14(15)19(24)22(16)17/h1-9,16-17,21H,10-12H2,(H,20,23)/t16-,17+/m0/s1
InChIKey WJOHFIGPSODSIV-DLBZAZTESA-N
Molecular Weight 321.380 g/mol
SMILES N1c2ccccc2C(N2[C@](C(NCc3ccccc3)=O)(CC[C@]12[H])[H])=O
SPLASH splash10-0079-0906000000-140cb9ee9737c5c08aee
Source of Spectrum H1-51-1271-32
Synonyms (1S,3aR)-N-benzyl-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-1-carboxamide 9-Oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-1-benzylcarboxamide (1S,3aR)-9-oxo-N-(phenylmethyl)-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-b]quinazoline-1-carboxamide (1S,3aR)-N-benzyl-9-oxo-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-b]quinazoline-1-carboxamide (1S,3aR)-9-oxidanylidene-N-(phenylmethyl)-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-b]quinazoline-1-carboxamide
Wiley ID 817109