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2-[5,6-dihydrobenzo[h]quinazolin-4-yl(methyl)amino]propanoic acid
SpectraBase Compound ID 9ck4qlTlCf5
InChI InChI=1S/C16H17N3O2/c1-10(16(20)21)19(2)15-13-8-7-11-5-3-4-6-12(11)14(13)17-9-18-15/h3-6,9-10H,7-8H2,1-2H3,(H,20,21)
InChIKey ZOMROOASVRCKLQ-UHFFFAOYSA-N
Mol Weight 283.33 g/mol
Molecular Formula C16H17N3O2
Exact Mass 283.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4W9bmorBbyI
Name 2-[5,6-dihydrobenzo[h]quinazolin-4-yl(methyl)amino]propanoic acid
Alternate Name(s) 2-[5,6-dihydrobenzo[h]quinazolin-4-yl(methyl)amino]propionic acid
CAS Registry Number 97248-97-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3O2
InChI InChI=1S/C16H17N3O2/c1-10(16(20)21)19(2)15-13-8-7-11-5-3-4-6-12(11)14(13)17-9-18-15/h3-6,9-10H,7-8H2,1-2H3,(H,20,21)
InChIKey ZOMROOASVRCKLQ-UHFFFAOYSA-N
Molecular Weight 283.331 g/mol
SMILES OC(C(N(c1c2c(-c3ccccc3CC2)ncn1)C)C)=O
SPLASH splash10-00kr-0090000000-fa369936665ffe0b8f8d
Source of Spectrum Y-22-188-4
Wiley ID 1286999