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(1S*,3S*,4R*)-3,4-Dihydroxycyclohexane-1-carbonitrile
SpectraBase Compound ID ANBp8zTRsyK
InChI InChI=1S/C7H11NO2/c8-4-5-1-2-6(9)7(10)3-5/h5-7,9-10H,1-3H2/t5-,6+,7-/m0/s1
InChIKey RUGLYPKOIMNKIT-XVMARJQXSA-N
Mol Weight 141.17 g/mol
Molecular Formula C7H11NO2
Exact Mass 141.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOzO0MfJWlm
Name (1S*,3S*,4R*)-3,4-Dihydroxycyclohexane-1-carbonitrile
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11NO2
InChI InChI=1S/C7H11NO2/c8-4-5-1-2-6(9)7(10)3-5/h5-7,9-10H,1-3H2/t5-,6+,7-/m0/s1
InChIKey RUGLYPKOIMNKIT-XVMARJQXSA-N
Molecular Weight 141.170 g/mol
SMILES O[C@]1(C[C@](CC[C@]1(O)[H])(C#N)[H])[H]
SPLASH splash10-0gba-9100000000-afb9bb78621114ddd6c7
Source of Spectrum F5-2-1124-syn--41
Synonyms (1S,3S,4R)-3,4-dihydroxycyclohexanecarbonitrile (1S,3S,4R)-3,4-dihydroxy-1-cyclohexanecarbonitrile (1S,3S,4R)-3,4-dihydroxycyclohexane-1-carbonitrile (1S,3S,4R)-3,4-bis(oxidanyl)cyclohexane-1-carbonitrile
Wiley ID 1731815