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5,8-METHANO-4-PARA-TOLYL-4A,5,6,7,8,8A-HEXYHYDRO-2H-PHTHALAZIN-1-ONE
SpectraBase Compound ID JT6OJtOHFF5
InChI InChI=1S/C16H18N2O/c1-9-2-4-10(5-3-9)15-13-11-6-7-12(8-11)14(13)16(19)18-17-15/h2-5,11-14H,6-8H2,1H3,(H,18,19)/t11-,12+,13?,14?/m0/s1
InChIKey PTOMBHMOSXDPCR-MRFVTOPCSA-N
Mol Weight 254.33 g/mol
Molecular Formula C16H18N2O
Exact Mass 254.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SylqoLk2K
Name 4-(p-Methylphenyl)-5,8-(endo-methylene)-hexahydro-1(2H)-phthalazinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O
InChI InChI=1S/C16H18N2O/c1-9-2-4-10(5-3-9)15-13-11-6-7-12(8-11)14(13)16(19)18-17-15/h2-5,11-14H,6-8H2,1H3,(H,18,19)/t11-,12+,13?,14?/m0/s1
InChIKey PTOMBHMOSXDPCR-MRFVTOPCSA-N
Molecular Weight 254.333 g/mol
SMILES N1C(C2[C@]3(C[C@@](C2C(=N1)c1ccc(cc1)C)(CC3)[H])[H])=O
SPLASH splash10-0f79-0980000000-ed76cee8278b155ae529
Source of Spectrum SK-23-2963-5
Wiley ID 865956