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5-([1,3]Dioxolane-2-ylmethyl)-3-phenyl-hexahydro-oxazolo[3,2-a]pyridine-5-carbonitrile
SpectraBase Compound ID 2iBS9MmffPl
InChI InChI=1S/C18H22N2O3/c19-12-18(10-17-21-8-9-22-17)7-6-16-20(13-18)15(11-23-16)14-4-2-1-3-5-14/h1-5,15-17H,6-11,13H2/t15-,16+,18+/m0/s1
InChIKey KZZOXFRUNIGVOP-LZLYRXPVSA-N
Mol Weight 314.39 g/mol
Molecular Formula C18H22N2O3
Exact Mass 314.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cj4mj4Vk5wy
Name 5-([1,3]Dioxolane-2-ylmethyl)-3-phenyl-hexahydro-oxazolo[3,2-a]pyridine-5-carbonitrile
Alternate Name(s) (3R,6S,8aR)-6-[1,3]Dioxolan-2-ylmethyl-3-phenyl-hexahydro-oxazolo[3,2-a]pyridine-6-carbonitrile 5-(1,3-dioxolan-2-ylmethyl)-3-phenylhexahydro-5H-[1,3]oxazolo[3,2-a]pyridine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O3
InChI InChI=1S/C18H22N2O3/c19-12-18(10-17-21-8-9-22-17)7-6-16-20(13-18)15(11-23-16)14-4-2-1-3-5-14/h1-5,15-17H,6-11,13H2/t15-,16+,18+/m0/s1
InChIKey KZZOXFRUNIGVOP-LZLYRXPVSA-N
Molecular Weight 314.385 g/mol
SMILES [C@]1(N2[C@](OC1)(CC[C@](C2)(C#N)CC1OCCO1)[H])(c1ccccc1)[H]
SPLASH splash10-03du-0291000000-52750fcf2f7bdb0d75b9
Source of Spectrum J-61-4952-5
Wiley ID 1315159