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3'-Ethyl-1,3',7,7-tetramethylspiro[bicyclo[2.2.1]heptane-2,1'-cyclobutane]
SpectraBase Compound ID 703HFUZo5Z7
InChI InChI=1S/C16H28/c1-6-14(4)10-16(11-14)9-12-7-8-15(16,5)13(12,2)3/h12H,6-11H2,1-5H3/t12-,14-,15-,16-/m0/s1
InChIKey NHBUSLVVCRWHDK-TUUVXOQKSA-N
Mol Weight 220.4 g/mol
Molecular Formula C16H28
Exact Mass 220.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rAuO23sYfr
Name 3'-Ethyl-1,3',7,7-tetramethylspiro[bicyclo[2.2.1]heptane-2,1'-cyclobutane]
Appearance Colorless liquid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28
GC Oven Program Oven temp 150oC
InChI InChI=1S/C16H28/c1-6-14(4)10-16(11-14)9-12-7-8-15(16,5)13(12,2)3/h12H,6-11H2,1-5H3/t12-,14-,15-,16-/m0/s1
InChIKey NHBUSLVVCRWHDK-TUUVXOQKSA-N
Instrument Name Shimadzu GCMS-QP2010 Plus
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2478
Molecular Weight 220.400 g/mol
SMILES C1[C@]2(C([C@@](C1)(C[C@]21C[C@](C1)(CC)C)[H])(C)C)C
SPLASH splash10-0a4i-4900000000-c2c3539c7559a881ca01
Sample Comments anti isomer
Source of Spectrum Y-53-1755-3
Wiley ID 1876659