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(6aS)-2-methoxy-3-(2-oxiranylmethoxy)-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
SpectraBase Compound ID FP1uU3zKDr4
InChI InChI=1S/C16H18N2O4/c1-20-14-5-12-13(6-15(14)22-9-11-8-21-11)17-7-10-3-2-4-18(10)16(12)19/h5-7,10-11H,2-4,8-9H2,1H3/t10-,11?/m0/s1
InChIKey FKAJITXNKPMLAE-VUWPPUDQSA-N
Mol Weight 302.33 g/mol
Molecular Formula C16H18N2O4
Exact Mass 302.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4L5qBnNOe1C
Name (6aS)-2-methoxy-3-(2-oxiranylmethoxy)-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 C16H18N2O4
InChI InChI=1S/C16H18N2O4/c1-20-14-5-12-13(6-15(14)22-9-11-8-21-11)17-7-10-3-2-4-18(10)16(12)19/h5-7,10-11H,2-4,8-9H2,1H3/t10-,11?/m0/s1
InChIKey FKAJITXNKPMLAE-VUWPPUDQSA-N
Molecular Weight 302.330 g/mol
SMILES C1=Nc2c(C(N3[C@]1(CCC3)[H])=O)cc(c(c2)OCC1CO1)OC
SPLASH splash10-0udi-1019000000-f19e93ae7d35b1352d72
Source of Spectrum F2-42-4038-6
Synonyms (6aS)-2-methoxy-3-(oxiran-2-ylmethoxy)-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one (6aS)-3-glycidoxy-2-methoxy-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
Wiley ID 1600438