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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 12fZTMU9upb
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 C1N2Cc3cc(ccc3N1Cc1c2ccc(C)c1)C
SPLASH splash10-0udi-3290000000-a3ea40fef91f11fc4d56
Source of Spectrum CF-9-509-0
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 1556634