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1,7-Dimethyl-2,2-ethylenedioxy-7-(1'-cyano-4'-hydroxybutyl)norbornane
SpectraBase Compound ID 58YIXn55hXb
InChI InChI=1S/C16H25NO3/c1-14-6-5-12(10-16(14)19-8-9-20-16)15(14,2)13(11-17)4-3-7-18/h12-13,18H,3-10H2,1-2H3
InChIKey SDTGKRBETXCQCU-UHFFFAOYSA-N
Mol Weight 279.38 g/mol
Molecular Formula C16H25NO3
Exact Mass 279.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTy87HzObsX
Name 1,7-Dimethyl-2,2-ethylenedioxy-7-(1'-cyano-4'-hydroxybutyl)norbornane
Alternate Name(s) 2-{1,7-dimethylspiro[bicyclo[2.2.1]heptane-2,2'-[1,3]dioxolane]-7-yl}-5-hydroxypentanenitrile
CAS Registry Number 119018-40-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO3
InChI InChI=1S/C16H25NO3/c1-14-6-5-12(10-16(14)19-8-9-20-16)15(14,2)13(11-17)4-3-7-18/h12-13,18H,3-10H2,1-2H3
InChIKey SDTGKRBETXCQCU-UHFFFAOYSA-N
Molecular Weight 279.380 g/mol
SMILES OCCCC(C#N)C1(C2(C3(CC1CC2)OCCO3)C)C
SPLASH splash10-0002-9400000000-96f3ba77b22ff90db590
Source of Spectrum I-66-1800-28
Wiley ID 1283065