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Biotin-N-(1'-octyl)-amide
SpectraBase Compound ID 7qjAp0R3yZG
InChI InChI=1S/C18H33N3O2S/c1-2-3-4-5-6-9-12-19-16(22)11-8-7-10-15-17-14(13-24-15)20-18(23)21-17/h14-15,17H,2-13H2,1H3,(H,19,22)(H2,20,21,23)/t14-,15-,17-/m0/s1
InChIKey VYIYVLKFRPSFCT-ZOBUZTSGSA-N
Mol Weight 355.5 g/mol
Molecular Formula C18H33N3O2S
Exact Mass 355.229348 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Rf85Hg4fFW
Name Biotin-N-(1'-octyl)-amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H33N3O2S
InChI InChI=1S/C18H33N3O2S/c1-2-3-4-5-6-9-12-19-16(22)11-8-7-10-15-17-14(13-24-15)20-18(23)21-17/h14-15,17H,2-13H2,1H3,(H,19,22)(H2,20,21,23)/t14-,15-,17-/m0/s1
InChIKey VYIYVLKFRPSFCT-ZOBUZTSGSA-N
Molecular Weight 355.541 g/mol
SMILES N1[C@@]2([C@](CCCCC(=O)NCCCCCCCC)(SC[C@@]2(NC1=O)[H])[H])[H]
SPLASH splash10-0f8a-0940000000-d7abf5a9cd18c19d7e69
Source of Spectrum SK-27-2211-5
Synonyms 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-octylpentanamide 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-octylpentanamide 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-octyl-pentanamide 5-[(3aS,4S,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-octyl-pentanamide
Wiley ID 867988