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1-(tert-butylamino)-2-((3R,5R,8R,8aR)-3,8-dimethyl-1,2,3,5,6,7,8,8a-octahydroazulen-5-yl)propan-2-ol
SpectraBase Compound ID DnCDPkVEYMz
InChI InChI=1S/C19H35NO/c1-13-7-9-15(11-17-14(2)8-10-16(13)17)19(6,21)12-20-18(3,4)5/h11,13-16,20-21H,7-10,12H2,1-6H3/t13-,14-,15-,16-,19?/m1/s1
InChIKey ZFFXHCYXUHXCAC-KPHXGZOSSA-N
Mol Weight 293.5 g/mol
Molecular Formula C19H35NO
Exact Mass 293.271865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoTKjlNgl9I
Name 1-(tert-butylamino)-2-((3R,5R,8R,8aR)-3,8-dimethyl-1,2,3,5,6,7,8,8a-octahydroazulen-5-yl)propan-2-ol
Classification Sesquiterpenoids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 293.271864750 u
Formula C19H35NO
InChI InChI=1S/C19H35NO/c1-13-7-9-15(11-17-14(2)8-10-16(13)17)19(6,21)12-20-18(3,4)5/h11,13-16,20-21H,7-10,12H2,1-6H3/t13-,14-,15-,16-,19?/m1/s1
InChIKey ZFFXHCYXUHXCAC-KPHXGZOSSA-N
Molecular Weight 293.495 g/mol
Number of Peaks 25
SMILES N(CC([C@@]1(CC[C@]([C@]2(CC[C@](C2=C1)(C)[H])[H])(C)[H])[H])(C)O)C(C)(C)C
SPLASH splash10-00dr-9210000000-5128046e75d79156c1a3
Source of Spectrum FF-5-13-13_3 (DOI: 10.1002/ffj.2730050102)
Wiley ID 1801191