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(6aS)-2-hydroxy-3-methoxy-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
SpectraBase Compound ID 5STG1hop2yf
InChI InChI=1S/C13H14N2O3/c1-18-12-6-10-9(5-11(12)16)13(17)15-4-2-3-8(15)7-14-10/h5-8,16H,2-4H2,1H3/t8-/m0/s1
InChIKey KZQGSWDWCRWKSC-QMMMGPOBSA-N
Mol Weight 246.27 g/mol
Molecular Formula C13H14N2O3
Exact Mass 246.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgvktBy3aJg
Name (6aS)-2-hydroxy-3-methoxy-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O3
InChI InChI=1S/C13H14N2O3/c1-18-12-6-10-9(5-11(12)16)13(17)15-4-2-3-8(15)7-14-10/h5-8,16H,2-4H2,1H3/t8-/m0/s1
InChIKey KZQGSWDWCRWKSC-QMMMGPOBSA-N
Molecular Weight 246.266 g/mol
SMILES Oc1cc2C(N3[C@](C=Nc2cc1OC)(CCC3)[H])=O
SPLASH splash10-0002-3290000000-0ca5b1f38869389c5336
Source of Spectrum AT-34-1378-4
Synonyms (6aS)-3-methoxy-2-oxidanyl-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
Wiley ID 852374