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3-(10'-methyl-trans-2'decalinyl)butyronitrile
SpectraBase Compound ID BIO0D43DRm0
InChI InChI=1S/C15H25N/c1-12(7-10-16)13-6-9-15(2)8-4-3-5-14(15)11-13/h12-14H,3-9,11H2,1-2H3/t12?,13?,14-,15-/m1/s1
InChIKey XOADZOSPMSQSGK-NEXFUWMNSA-N
Mol Weight 219.37 g/mol
Molecular Formula C15H25N
Exact Mass 219.1987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3wS69VWefYr
Name 3-(10'-methyl-trans-2'decalinyl)butyronitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H25N
InChI InChI=1S/C15H25N/c1-12(7-10-16)13-6-9-15(2)8-4-3-5-14(15)11-13/h12-14H,3-9,11H2,1-2H3/t12?,13?,14-,15-/m1/s1
InChIKey XOADZOSPMSQSGK-NEXFUWMNSA-N
Molecular Weight 219.372 g/mol
SMILES [C@]12([C@@](CC(CC2)C(CC#N)C)(CCCC1)[H])C
SPLASH splash10-0udi-0290000000-27626d3f1e1ce5d79716
Source of Spectrum C-114-4077-0
Synonyms 3-[(4aR,8aR)-4a-methyldecahydro-2-naphthalenyl]butanenitrile
Wiley ID 1219102