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2-Pyridinepropanol, .gamma.-2,6,10-cyclododecatrien-1-yl-.alpha.-methyl-
SpectraBase Compound ID CWOXQyESKoV
InChI InChI=1S/C21H29NO/c1-18(23)17-20(21-15-11-12-16-22-21)19-13-9-7-5-3-2-4-6-8-10-14-19/h2-3,8-13,15-16,18-20,23H,4-7,14,17H2,1H3/b3-2-,10-8-,13-9-
InChIKey ZXQWLYAOHWXBIV-ONALWXTLSA-N
Mol Weight 311.47 g/mol
Molecular Formula C21H29NO
Exact Mass 311.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUYhmuLWb0A
Name 2-Pyridinepropanol, .gamma.-2,6,10-cyclododecatrien-1-yl-.alpha.-methyl-
CAS Registry Number 98700-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO
InChI InChI=1S/C21H29NO/c1-18(23)17-20(21-15-11-12-16-22-21)19-13-9-7-5-3-2-4-6-8-10-14-19/h2-3,8-13,15-16,18-20,23H,4-7,14,17H2,1H3/b3-2-,10-8-,13-9-
InChIKey ZXQWLYAOHWXBIV-ONALWXTLSA-N
Molecular Weight 311.469 g/mol
SMILES OC(CC(c1ncccc1)C1\C=C/CC\C=C/CC\C=C/C1)C
SPLASH splash10-0a4l-4970000000-3ba345bbb9d6e9c9ed68
Source of Spectrum K-118-2337-8
Synonyms Cyclododecane, 2-pyridinepropanol deriv. 4-(2,6,10-cyclododecatrien-1-yl)-4-(2-pyridinyl)-2-butanol 4-(all-trans-2,6,10-cyclododecatrien-1-yl)-4-(2-pyridinyl)-2-butanol
Wiley ID 1312718