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3-Hydroxy-2,2,3-trimethylheptanenitrle
SpectraBase Compound ID E0VjWOSLMiB
InChI InChI=1S/C10H19NO/c1-5-6-7-10(4,12)9(2,3)8-11/h12H,5-7H2,1-4H3
InChIKey ORUPISOAVVMRIX-UHFFFAOYSA-N
Mol Weight 169.27 g/mol
Molecular Formula C10H19NO
Exact Mass 169.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4UQZQpOi2SW
Name 3-Hydroxy-2,2,3-trimethylheptanenitrle
Alternate Name(s) 3-Hydroxy-2,2,3-trimethylheptanenitrile
CAS Registry Number 138785-90-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H19NO
InChI InChI=1S/C10H19NO/c1-5-6-7-10(4,12)9(2,3)8-11/h12H,5-7H2,1-4H3
InChIKey ORUPISOAVVMRIX-UHFFFAOYSA-N
Molecular Weight 169.268 g/mol
SMILES OC(C(C#N)(C)C)(CCCC)C
SPLASH splash10-0fk9-9300000000-646355c6c70ca4a0be08
Source of Spectrum K-125-904-12
Wiley ID 1165940