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3b,4,5,6-Tetrahydro-5H-pyrrolo-[2,1-c]tetrazolo[1,5-a]-1,4]benzodiazepin-8-one
SpectraBase Compound ID UFCk1TRMil
InChI InChI=1S/C12H11N5O/c18-12-8-4-1-2-5-9(8)17-11(13-14-15-17)10-6-3-7-16(10)12/h1-2,4-5,10H,3,6-7H2
InChIKey LXNKOINFGJGFJI-UHFFFAOYSA-N
Mol Weight 241.25 g/mol
Molecular Formula C12H11N5O
Exact Mass 241.09636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Exj8aCJYkbL
Name 3b,4,5,6-Tetrahydro-5H-pyrrolo-[2,1-c]tetrazolo[1,5-a]-1,4]benzodiazepin-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N5O
InChI InChI=1S/C12H11N5O/c18-12-8-4-1-2-5-9(8)17-11(13-14-15-17)10-6-3-7-16(10)12/h1-2,4-5,10H,3,6-7H2
InChIKey LXNKOINFGJGFJI-UHFFFAOYSA-N
Molecular Weight 241.254 g/mol
SMILES c12[n](nnn2)-c2c(cccc2)C(N2C1CCC2)=O
SPLASH splash10-052f-0590000000-a2a1cd24ca774bdf769e
Source of Spectrum Y-34-449-22
Synonyms 11,12,13,13a-tetrahydro-8H-pyrrolo[2,1-c]tetraazolo[1,5-a][1,4]benzodiazepin-8-one 3b,4,5,6-Tetrahydro-1,2,3,6a,11b-pentaaza-benzo[g]cyclopenta[e]azulen-7-one
Wiley ID 1243959