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2-[3-[(N-Isopropylaminocarbonyl]propyl]-4-(3-pyridyl)-1(2H)-phthalazinone
SpectraBase Compound ID 68qpMPgpgnP
InChI InChI=1S/C20H22N4O2/c1-14(2)22-18(25)10-6-12-24-20(26)17-9-4-3-8-16(17)19(23-24)15-7-5-11-21-13-15/h3-5,7-9,11,13-14H,6,10,12H2,1-2H3,(H,22,25)
InChIKey VQASVRBWLFIKEF-UHFFFAOYSA-N
Mol Weight 350.42 g/mol
Molecular Formula C20H22N4O2
Exact Mass 350.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dd9bYHsZmFd
Name 2-[3-[(N-Isopropylaminocarbonyl]propyl]-4-(3-pyridyl)-1(2H)-phthalazinone
Alternate Name(s) 4-[1-oxo-4-(3-pyridinyl)-2-phthalazinyl]-N-propan-2-ylbutanamide 4-(1-oxo-4-pyridin-3-ylphthalazin-2-yl)-N-propan-2-ylbutanamide N-isopropyl-4-[1-oxo-4-(3-pyridyl)phthalazin-2-yl]butanamide 4-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)-N-propan-2-yl-butanamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N4O2
InChI InChI=1S/C20H22N4O2/c1-14(2)22-18(25)10-6-12-24-20(26)17-9-4-3-8-16(17)19(23-24)15-7-5-11-21-13-15/h3-5,7-9,11,13-14H,6,10,12H2,1-2H3,(H,22,25)
InChIKey VQASVRBWLFIKEF-UHFFFAOYSA-N
Molecular Weight 350.422 g/mol
SMILES N(C(CCCN1N=C(c2c(cccc2)C1=O)c1cnccc1)=O)C(C)C
SPLASH splash10-0udi-0092000000-76c8a47154ec46cefa06
Source of Spectrum E1-36-4066-11
Wiley ID 1574845