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trans-2,3-Epoxycyclohexane-1-carbonitrile
SpectraBase Compound ID CLz408kbAVO
InChI InChI=1S/C7H9NO/c8-4-5-2-1-3-6-7(5)9-6/h5-7H,1-3H2/t5?,6-,7-/m0/s1
InChIKey KEXPBJJFCKWMHW-BYRXKDITSA-N
Mol Weight 123.15 g/mol
Molecular Formula C7H9NO
Exact Mass 123.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LvzZLBNeACL
Name trans-2,3-Epoxycyclohexane-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9NO
InChI InChI=1S/C7H9NO/c8-4-5-2-1-3-6-7(5)9-6/h5-7H,1-3H2/t5?,6-,7-/m0/s1
InChIKey KEXPBJJFCKWMHW-BYRXKDITSA-N
Molecular Weight 123.155 g/mol
SMILES [C@]12(O[C@]1(CCCC2C#N)[H])[H]
SPLASH splash10-0gbc-9000000000-ccbd2a0679c8f88c555c
Source of Spectrum J-61-1839-5
Synonyms (1S,6S)-7-oxabicyclo[4.1.0]heptane-2-carbonitrile
Wiley ID 1128445