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trans-11b-(p-tolyl)-2,3,4,5,7a,8,9,10,11,11a-decahydro-1H-[1,3]diazepino[2,1-a]isoindol-7-one
SpectraBase Compound ID ADGhciOOmbl
InChI InChI=1S/C19H26N2O/c1-14-8-10-15(11-9-14)19-17-7-3-2-6-16(17)18(22)21(19)13-5-4-12-20-19/h8-11,16-17,20H,2-7,12-13H2,1H3/t16-,17-,19?/m0/s1
InChIKey RKMBBHVUDJTEGR-YGYNJSFOSA-N
Mol Weight 298.43 g/mol
Molecular Formula C19H26N2O
Exact Mass 298.204513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSoHYO2Qfeb
Name trans-11b-(p-tolyl)-2,3,4,5,7a,8,9,10,11,11a-decahydro-1H-[1,3]diazepino[2,1-a]isoindol-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26N2O
InChI InChI=1S/C19H26N2O/c1-14-8-10-15(11-9-14)19-17-7-3-2-6-16(17)18(22)21(19)13-5-4-12-20-19/h8-11,16-17,20H,2-7,12-13H2,1H3/t16-,17-,19?/m0/s1
InChIKey RKMBBHVUDJTEGR-YGYNJSFOSA-N
Instrument Name VG Analytical MM 7070E
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290081013
Molecular Weight 298.430 g/mol
SMILES N1C2(N(CCCC1)C([C@@]1([C@@]2(CCCC1)[H])[H])=O)c1ccc(cc1)C
SPLASH splash10-000i-6970000000-d2b5c1204a9df189e88c
Source of Spectrum RCM-8-860-3
Wiley ID 1835603