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2-Chloro-4-methoxy-5-methyl-7,8,9,10,10a,11-hexahydro-6aH-benzo[b]pyrido[2,3-e][1,4]diazepine
SpectraBase Compound ID 1pe5BWlqbvO
InChI InChI=1S/C14H18ClN3O/c1-8-13-11(19-2)7-12(15)18-14(13)17-10-6-4-3-5-9(10)16-8/h7,9-10H,3-6H2,1-2H3,(H,17,18)
InChIKey IOWWTDZHLQFZHA-UHFFFAOYSA-N
Mol Weight 279.77 g/mol
Molecular Formula C14H18ClN3O
Exact Mass 279.11384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTZHPqtgwC8
Name 2-Chloro-4-methoxy-5-methyl-7,8,9,10,10a,11-hexahydro-6aH-benzo[b]pyrido[2,3-e][1,4]diazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18ClN3O
InChI InChI=1S/C14H18ClN3O/c1-8-13-11(19-2)7-12(15)18-14(13)17-10-6-4-3-5-9(10)16-8/h7,9-10H,3-6H2,1-2H3,(H,17,18)
InChIKey IOWWTDZHLQFZHA-UHFFFAOYSA-N
Molecular Weight 279.771 g/mol
SMILES N1C2C(N=C(c3c1nc(cc3OC)Cl)C)CCCC2
SPLASH splash10-03g0-0190000000-f629ccfb6dd3ddbd8c5b
Source of Spectrum C5-2003-2523-5
Synonyms (R*,R*)-2-Chloro-4-methoxy-5-methyl-7,8,9,10,10a,11-hexahydro-6aH-benzo[b]pyrido[2,3-e][1,4]diazepine 2-Chloro-4-methoxy-5-methyl-7,8,9,10,10a,11-hexahydro-6aH-pyrido[2,3-b][1,5]benzodiazepine 2-Chloro-5-methyl-7,8,9,10,10a,11-hexahydro-6aH-pyrido[2,3-b][1,5]benzodiazepin-4-yl methyl ether
Wiley ID 1616122