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[(1R,2R)-2-tert-butylcyclopropyl]benzene
SpectraBase Compound ID DVbQeDEOsyl
InChI InChI=1S/C13H18/c1-13(2,3)12-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1-3H3/t11-,12+/m0/s1
InChIKey WZWFYTWSMRJZIT-NWDGAFQWSA-N
Mol Weight 174.29 g/mol
Molecular Formula C13H18
Exact Mass 174.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMiNh2Sj9tK
Name [(1R,2R)-2-tert-butylcyclopropyl]benzene
CAS Registry Number 33450-88-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18
InChI InChI=1S/C13H18/c1-13(2,3)12-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1-3H3/t11-,12+/m0/s1
InChIKey WZWFYTWSMRJZIT-NWDGAFQWSA-N
Molecular Weight 174.287 g/mol
SMILES [C@]1([C@](c2ccccc2)(C1)[H])(C(C)(C)C)[H]
SPLASH splash10-0uxu-2900000000-6b5d52cd110f9102217c
Source of Spectrum AC-133-826-0
Wiley ID 812177