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SXPSZIHEWFTLEQ-UHFFFAOYSA-N
SpectraBase Compound ID IsHX8QhGyi1
InChI InChI=1S/C17H18N2/c1-12-3-5-16-14(7-12)9-18-11-19(16)10-15-8-13(2)4-6-17(15)18/h3-8H,9-11H2,1-2H3
InChIKey SXPSZIHEWFTLEQ-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C17H18N2
Exact Mass 250.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfEGl31syH9
Name Mianserin metabolite
CAS Registry Number 529-81-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2
InChI InChI=1S/C17H18N2/c1-12-3-5-16-14(7-12)9-18-11-19(16)10-15-8-13(2)4-6-17(15)18/h3-8H,9-11H2,1-2H3
InChIKey SXPSZIHEWFTLEQ-UHFFFAOYSA-N
Molecular Weight 250.345 g/mol
SMILES c1cc2c(cc1C)CN1c3ccc(cc3CN2C1)C
SPLASH splash10-0f6x-1960000000-9fb9be9fd4750e542cf2
Source of Spectrum JZ-1992-1105-0
Synonyms 6,11-Dihydro-2:8-dimethyl-5:11-endo-methylenephenhomazine 2,8-Dimethyl-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine Troger'S base
Wiley ID 1254052