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1-(1-Adamantyl)-3-cyano-5-nitrobenzene
SpectraBase Compound ID GcYfIImJW5g
InChI InChI=1S/C17H18N2O2/c18-10-14-4-15(6-16(5-14)19(20)21)17-7-11-1-12(8-17)3-13(2-11)9-17/h4-6,11-13H,1-3,7-9H2
InChIKey ZEBIUCGYZJGHIB-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C17H18N2O2
Exact Mass 282.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jRcRnRJBgr
Name 1-(1-Adamantyl)-3-cyano-5-nitrobenzene
CAS Registry Number 71466-54-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O2
InChI InChI=1S/C17H18N2O2/c18-10-14-4-15(6-16(5-14)19(20)21)17-7-11-1-12(8-17)3-13(2-11)9-17/h4-6,11-13H,1-3,7-9H2
InChIKey ZEBIUCGYZJGHIB-UHFFFAOYSA-N
Molecular Weight 282.343 g/mol
SMILES C12(c3cc(N(=O)=O)cc(C#N)c3)CC3CC(C1)CC(C2)C3
SPLASH splash10-003u-5190000000-fff8943cd7dcc112511e
Source of Spectrum KC-1979-472-0
Synonyms 3-(1-adamantyl)-5-nitrobenzonitrile Benzonitrile, 3-nitro-5-tricyclo[3.3.1.1(3,7)]dec-1-yl-
Wiley ID 1286097