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2-[(8Z,11R)-11-Hydroxyheptadec-8-enyl]-5-chloro-1H-benzimidazole
SpectraBase Compound ID 8Btu9TVyj
InChI InChI=1S/C24H37ClN2O/c1-2-3-4-11-14-21(28)15-12-9-7-5-6-8-10-13-16-24-26-22-18-17-20(25)19-23(22)27-24/h9,12,17-19,21,28H,2-8,10-11,13-16H2,1H3,(H,26,27)/b12-9-/t21-/m1/s1
InChIKey QOACPAKHUARRSL-ZDKIGPTLSA-N
Mol Weight 405.0 g/mol
Molecular Formula C24H37ClN2O
Exact Mass 404.259442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fy9p3kBwxqH
Name 2-[(8Z,11R)-11-Hydroxyheptadec-8-enyl]-5-chloro-1H-benzimidazole
Alternate Name(s) (Z,7R)-17-(6-chloro-1H-benzimidazol-2-yl)-9-heptadecen-7-ol (Z,7R)-17-(6-chloranyl-1H-benzimidazol-2-yl)heptadec-9-en-7-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H37ClN2O
InChI InChI=1S/C24H37ClN2O/c1-2-3-4-11-14-21(28)15-12-9-7-5-6-8-10-13-16-24-26-22-18-17-20(25)19-23(22)27-24/h9,12,17-19,21,28H,2-8,10-11,13-16H2,1H3,(H,26,27)/b12-9-/t21-/m1/s1
InChIKey QOACPAKHUARRSL-ZDKIGPTLSA-N
Molecular Weight 405.026 g/mol
SMILES [nH]1c(CCCCCCC\C=C/C[C@@](CCCCCC)(O)[H])nc2c1ccc(c2)Cl
SPLASH splash10-0pvj-0095600000-d1ce2fcb0e5c6ec98327
Source of Spectrum F2-44-1756-4cC
Wiley ID 1716342