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7-Iodo-1,2,3,11a-tetrahydro-5H-pyrrolo[2,1-c]-{1,4]benzodiazepine-5-one
SpectraBase Compound ID BJRv6N1MRSW
InChI InChI=1S/C12H11IN2O/c13-8-3-4-11-10(6-8)12(16)15-5-1-2-9(15)7-14-11/h3-4,6-7,9H,1-2,5H2
InChIKey PAFKBTMDRDFEFL-UHFFFAOYSA-N
Mol Weight 326.14 g/mol
Molecular Formula C12H11IN2O
Exact Mass 325.991608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QFEiaEUc4
Name 7-Iodo-1,2,3,11a-tetrahydro-5H-pyrrolo[2,1-c]-{1,4]benzodiazepine-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11IN2O
InChI InChI=1S/C12H11IN2O/c13-8-3-4-11-10(6-8)12(16)15-5-1-2-9(15)7-14-11/h3-4,6-7,9H,1-2,5H2
InChIKey PAFKBTMDRDFEFL-UHFFFAOYSA-N
Molecular Weight 326.137 g/mol
SMILES C1(c2c(N=CC3N1CCC3)ccc(c2)I)=O
SPLASH splash10-00ba-8279000000-04e5a6a41797903ae58b
Source of Spectrum B-51-1128-30
Synonyms 7-iodo-1,2,3,11a-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5-one
Wiley ID 746052