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1-ETHINYLCYCLOHEXYLCYANIDE
SpectraBase Compound ID 4P0O6sX7n2i
InChI InChI=1S/C9H11N/c1-2-9(8-10)6-4-3-5-7-9/h1H,3-7H2
InChIKey RJKHNDIOAQTVLX-UHFFFAOYSA-N
Mol Weight 133.19 g/mol
Molecular Formula C9H11N
Exact Mass 133.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IKMBZ5sAAxq
Name 1-ethynyl-1-cyclohexanecarbonitrile
Alternate Name(s) 1-Ethynylcyclohexanecarbonitrile 1-ethynylcyclohexane-1-carbonitrile Cyclohexanecarbonitrile, 1-ethynyl-
CAS Registry Number 138313-45-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11N
InChI InChI=1S/C9H11N/c1-2-9(8-10)6-4-3-5-7-9/h1H,3-7H2
InChIKey RJKHNDIOAQTVLX-UHFFFAOYSA-N
Molecular Weight 133.194 g/mol
SMILES C(#C)C1(C#N)CCCCC1
SPLASH splash10-001i-0900000000-d426b5457b22b4d681dd
Source of Spectrum K-125-528-6
Wiley ID 1134396