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7-Hydroxy-2,4-dimethyl-5H-benzo[b]-[1,4]diazepin-1-ium - Trifluoroacetate
SpectraBase Compound ID CfXAld44QCU
InChI InChI=1S/C11H12N2O/c1-7-5-8(2)13-11-6-9(14)3-4-10(11)12-7/h3-6,13-14H,1-2H3/p+1
InChIKey ROKSYIRIQHDIHJ-UHFFFAOYSA-O
Mol Weight 189.24 g/mol
Molecular Formula C11H13N2O
Exact Mass 189.102788 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7r20zvYr8P
Name 7-Hydroxy-2,4-dimethyl-5H-benzo[b]-[1,4]diazepin-1-ium - Trifluoroacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N2O
InChI InChI=1S/C11H12N2O/c1-7-5-8(2)13-11-6-9(14)3-4-10(11)12-7/h3-6,13-14H,1-2H3/p+1
InChIKey ROKSYIRIQHDIHJ-UHFFFAOYSA-O
Molecular Weight 189.238 g/mol
SMILES [NH+]1=C(C=C(C)Nc2c1ccc(c2)O)C
SPLASH splash10-000i-0900000000-edcd3d105ed0343713e5
Source of Spectrum F5-1-4348-18b
Synonyms 7-Hydroxy-2,4-dimethyl-5H-benzo[b]-[1,4]diazepin-1-ium - Hydrogensulfate 7-Hydroxy-2,4-dimethyl-5H-benzo[b]-[1,4]diazepin-1-ium-Hydrogensulfate 7-Hydroxy-2,4-dimethyl-5H-benzo[b]-[1,4]diazepin-1-ium-Trifluoroacetate 8-Hydroxy-2,4-dimethyl-1H-benzo[b][1,4]diazepin-5-ium
Wiley ID 1731622