Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-4-ol Hydrate

4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-4-ol Hydrate synonyms

Sabinene hydrate


Graphical representations:


View large 3D structure

Molecular Formula: C10H20O2

Natural Isotopic Abundance Mass: 172.2646

Mono-Isotopic Molecular Masses:

  • C12N14: 172.14632988
  • C13N14: 182.17987826
  • C12N15: 172.14632988
  • C13N15: 182.17987826

InChI string: InChI=1S/C10H18O.H2O/c1-7(2)10-5-4-9(3,11)8(10)6-10;/h7-8,11H,4-6H2,1-3H3;1H2/t8-,9-,10-;/m1./s1

MMCD: cq_01519
PubChem Compound (CID): 24890322

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,