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trans-3a,7a-3-Phenylhexahydrophthalide
SpectraBase Compound ID BW2A2hbBRoL
InChI InChI=1S/C14H16O2/c15-14-12-9-5-4-8-11(12)13(16-14)10-6-2-1-3-7-10/h1-3,6-7,11-13H,4-5,8-9H2/t11-,12-,13-/m1/s1
InChIKey LJPBGQJJWODJLW-JHJVBQTASA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ASC7hhjrWsu
Name TRANS-3A,7A-3-PHENYLHEXAHYDROPHTHALIDE
CAS Registry Number 86528-48-5
Compound Number 3D
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c15-14-12-9-5-4-8-11(12)13(16-14)10-6-2-1-3-7-10/h1-3,6-7,11-13H,4-5,8-9H2/t11-,12-,13-/m1/s1
InChIKey LJPBGQJJWODJLW-JHJVBQTASA-N
Literature Reference Author N.POURAHMADY,E.J.EISENBRAUN
Literature Reference Citation J.ORG.CHEM.,48,3067(1983)
Literature Reference DOI 10.1021/jo00166a027
Molecular Weight 216.280 g/mol
Solvent CDCl3
Source File Reference UNIW18898