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2-[(8Z,11R)-11-Hydroxyheptadec-8-enyl]-5-nitro-1H-benzimidazole
SpectraBase Compound ID 3ySCSp1ao1B
InChI InChI=1S/C24H37N3O3/c1-2-3-4-11-14-21(28)15-12-9-7-5-6-8-10-13-16-24-25-22-18-17-20(27(29)30)19-23(22)26-24/h9,12,17-19,21,28H,2-8,10-11,13-16H2,1H3,(H,25,26)/b12-9-/t21-/m1/s1
InChIKey CUJRWBUBAQUJIX-ZDKIGPTLSA-N
Mol Weight 415.6 g/mol
Molecular Formula C24H37N3O3
Exact Mass 415.283492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AuBmXAX7mHJ
Name 2-[(8Z,11R)-11-Hydroxyheptadec-8-enyl]-5-nitro-1H-benzimidazole
Alternate Name(s) (Z,7R)-17-(6-nitro-1H-benzimidazol-2-yl)-9-heptadecen-7-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H37N3O3
InChI InChI=1S/C24H37N3O3/c1-2-3-4-11-14-21(28)15-12-9-7-5-6-8-10-13-16-24-25-22-18-17-20(27(29)30)19-23(22)26-24/h9,12,17-19,21,28H,2-8,10-11,13-16H2,1H3,(H,25,26)/b12-9-/t21-/m1/s1
InChIKey CUJRWBUBAQUJIX-ZDKIGPTLSA-N
Molecular Weight 415.578 g/mol
SMILES [nH]1c(CCCCCCC\C=C/C[C@@](CCCCCC)(O)[H])nc2c1ccc(c2)N(=O)=O
SPLASH splash10-0gc0-0019500000-a837afac8d5e4d6ff83d
Source of Spectrum F2-44-1755-4cB
Wiley ID 1716346