For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
syn-4'-Cyano-5-chloro-4'-methylspiro[adamantane-2,2'-oxetane]
SpectraBase Compound ID IRHndQ36B19
InChI InChI=1S/C14H18ClNO/c1-12(8-16)7-14(17-12)10-2-9-3-11(14)6-13(15,4-9)5-10/h9-11H,2-7H2,1H3/t9-,10-,11+,12?,13-,14?
InChIKey QSIVQOUFNVQMIU-WBZFGESHSA-N
Mol Weight 251.76 g/mol
Molecular Formula C14H18ClNO
Exact Mass 251.107692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JR8K4xutwR1
Name syn-4'-Cyano-5-chloro-4'-methylspiro[adamantane-2,2'-oxetane]
Alternate Name(s) anti-4'-Cyano-5-chloro-4'-methylspiro[adamantane-2,2'-oxetane] 5-Chloro-4'-methylspiro[adamantane-2,2'-oxetane]-4'-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18ClNO
InChI InChI=1S/C14H18ClNO/c1-12(8-16)7-14(17-12)10-2-9-3-11(14)6-13(15,4-9)5-10/h9-11H,2-7H2,1H3/t9-,10-,11+,12?,13-,14?
InChIKey QSIVQOUFNVQMIU-WBZFGESHSA-N
Molecular Weight 251.757 g/mol
SMILES C12([C@@]3(C[C@]4(C[C@]2(C[C@](C4)(C3)[H])[H])Cl)[H])OC(C1)(C#N)C
SPLASH splash10-001r-4900000000-07513ab3ac1c3f7d40fc
Source of Spectrum KC-0-585-5
Wiley ID 821724