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5-(Ethynyl)-5-(N-tert-butoxycarbony)amino-2-phenyl-1,3-dioxacyclohexane
SpectraBase Compound ID DUA1T9r7Axe
InChI InChI=1S/C17H21NO4/c1-5-17(18-15(19)22-16(2,3)4)11-20-14(21-12-17)13-9-7-6-8-10-13/h1,6-10,14H,11-12H2,2-4H3,(H,18,19)
InChIKey FJXSZRVFILJIOA-UHFFFAOYSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AyISXzljUV
Name 5-(Ethynyl)-5-(N-tert-butoxycarbony)amino-2-phenyl-1,3-dioxacyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-5-17(18-15(19)22-16(2,3)4)11-20-14(21-12-17)13-9-7-6-8-10-13/h1,6-10,14H,11-12H2,2-4H3,(H,18,19)
InChIKey FJXSZRVFILJIOA-UHFFFAOYSA-N
Molecular Weight 303.358 g/mol
SMILES N(C1(C#C)COC(OC1)c1ccccc1)C(OC(C)(C)C)=O
SPLASH splash10-00ma-0970000000-f6449fe37a26df6a2429
Source of Spectrum F-67-2545-13a
Wiley ID 1686143