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2,3,3a,4,5,6-hexahydro-2-benzyl-4-methyl-5-hydroxy-6-azido-1H-isoindolinone
SpectraBase Compound ID F7X6n4UCNGg
InChI InChI=1S/C16H18N4O2/c1-10-13-9-20(8-11-5-3-2-4-6-11)16(22)12(13)7-14(15(10)21)18-19-17/h2-7,10,13-15,21H,8-9H2,1H3
InChIKey QNEJACRBZIIAGT-UHFFFAOYSA-N
Mol Weight 298.35 g/mol
Molecular Formula C16H18N4O2
Exact Mass 298.142976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pn8forSVYh
Name 2,3,3a,4,5,6-hexahydro-2-benzyl-4-methyl-5-hydroxy-6-azido-1H-isoindolinone
CAS Registry Number 114431-45-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N4O2
InChI InChI=1S/C16H18N4O2/c1-10-13-9-20(8-11-5-3-2-4-6-11)16(22)12(13)7-14(15(10)21)18-19-17/h2-7,10,13-15,21H,8-9H2,1H3
InChIKey QNEJACRBZIIAGT-UHFFFAOYSA-N
Molecular Weight 298.346 g/mol
SMILES OC1C(C=C2C(N(Cc3ccccc3)CC2C1C)=O)N=[N+]=[N-]
SPLASH splash10-052f-7090000000-8c4bfd12777d09dfdf56
Source of Spectrum AJ-60-3265-13
Synonyms 6-Azido-2-benzyl-5-hydroxy-4-methyl-2,3,3a,4,5,6-hexahydro-1H-isoindol-1-one
Wiley ID 1300861