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3beta-CHLORO-4alphaH-THUJANE

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3beta-CHLORO-4alphaH-THUJANE
SpectraBase Compound ID 3a0EJydFQDk
InChI InChI=1S/C10H17Cl/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-9H,4-5H2,1-3H3/t7-,8?,9+,10?/m0/s1
InChIKey FJBXABVISPZXQA-QGVKSAJWSA-N
Mol Weight 172.7 g/mol
Molecular Formula C10H17Cl
Exact Mass 172.101878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3NzyIQFErxQ
Name 3beta-CHLORO-4alphaH-THUJANE
Source of Sample J. C. Rees, D. Whittaker Org. Magn. Resonance 15, 363(1981)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17Cl
InChI InChI=1S/C10H17Cl/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-9H,4-5H2,1-3H3/t7-,8?,9+,10?/m0/s1
InChIKey FJBXABVISPZXQA-QGVKSAJWSA-N
Molecular Weight 172.70
Solvent Chloroform-d; Reference=TMS; Temperature=300 K Spectrometer= Varian XL-100
Synonyms THUJANE, 4AH-, 3B-CHLORO-,