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4,5,6-Metheno-4H-cyclopent[d]isoxazole, 3a,5,6,6a-tetrahydro-3-phenyl-, cis-
SpectraBase Compound ID 8DEQocQ5Ni4
InChI InChI=1S/C13H11NO/c1-2-4-6(5-3-1)12-11-9-7-8(9)10(7)13(11)15-14-12/h1-5,7-11,13H/t7-,8+,9?,10?,11?,13?
InChIKey NRTRAPRZMATUCF-KIFLOCALSA-N
Mol Weight 197.24 g/mol
Molecular Formula C13H11NO
Exact Mass 197.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2UhxHTHWtfq
Name 4,5,6-Metheno-4H-cyclopent[d]isoxazole, 3a,5,6,6a-tetrahydro-3-phenyl-, cis-
CAS Registry Number 103495-74-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO
InChI InChI=1S/C13H11NO/c1-2-4-6(5-3-1)12-11-9-7-8(9)10(7)13(11)15-14-12/h1-5,7-11,13H/t7-,8+,9?,10?,11?,13?
InChIKey NRTRAPRZMATUCF-KIFLOCALSA-N
Molecular Weight 197.237 g/mol
SMILES [C@]12([C@]3([H])C2C2ON=C(C2C13)c1ccccc1)[H]
SPLASH splash10-00kb-1900000000-c3774b56a490048151a2
Source of Spectrum K-119-955-2
Synonyms (3R,4S)-9-phenyl-7-oxa-8-azatetracyclo[4.3.0.0(2,4).0(3,5)]non-8-ene 9-Phenyl-7-oxa-8-azatetracyclo[4.3.0.0(2,4).0(3,5)]non-8-en
Wiley ID 1194648