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(4aS,8aR)-4-p-Tolyl-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one
SpectraBase Compound ID EScTeWjxWpF
InChI InChI=1S/C15H18N2O/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15(18)17-16-14/h6-9,12-13H,2-5H2,1H3,(H,17,18)/t12-,13+/m0/s1
InChIKey CAGGMZIQVSXHRG-QWHCGFSZSA-N
Mol Weight 242.32 g/mol
Molecular Formula C15H18N2O
Exact Mass 242.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9t2FswrDRmN
Name cis-4-(p-tolyl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N2O
InChI InChI=1S/C15H18N2O/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15(18)17-16-14/h6-9,12-13H,2-5H2,1H3,(H,17,18)/t12-,13+/m0/s1
InChIKey CAGGMZIQVSXHRG-QWHCGFSZSA-N
Instrument Name VG Analytical MM 7070E
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290081223
Molecular Weight 242.322 g/mol
SMILES N1N=C([C@@]2([C@](C1=O)(CCCC2)[H])[H])c1ccc(cc1)C
SPLASH splash10-0006-3790000000-e7179fc8551338f2e3a8
Source of Spectrum RCM-8-1022-3
Wiley ID 1835628