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tert-Butyl (3-cyclohexylpropa-1,2-dien-1-yl)(4-methoxyphenyl)carbamate
SpectraBase Compound ID 7paifDFzx5h
InChI InChI=1S/C21H29NO3/c1-21(2,3)25-20(23)22(18-12-14-19(24-4)15-13-18)16-8-11-17-9-6-5-7-10-17/h11-17H,5-7,9-10H2,1-4H3
InChIKey UNLDQUZIEHALFM-UHFFFAOYSA-N
Mol Weight 343.47 g/mol
Molecular Formula C21H29NO3
Exact Mass 343.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9eGknj5mjIy
Name tert-Butyl (3-cyclohexylpropa-1,2-dien-1-yl)(4-methoxyphenyl)carbamate
Appearance Yellow oil
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Exact Mass 343.214743795 u
Formula C21H29NO3
InChI InChI=1S/C21H29NO3/c1-21(2,3)25-20(23)22(18-12-14-19(24-4)15-13-18)16-8-11-17-9-6-5-7-10-17/h11-17H,5-7,9-10H2,1-4H3
InChIKey UNLDQUZIEHALFM-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704804
Molecular Weight 343.467 g/mol
Reported Formula C21H29NO3
SMILES C(OC(N(C1=CC=C(C=C1)OC)C=C=CC1CCCCC1)=O)(C)(C)C
SPLASH splash10-000l-0091000000-499f457843f7b0b43fca
Source of Spectrum ACI-56-SM7-1i (DOI: 10.1002/anie.201704804)
Thin-Layer Chromatography 0.64 (petroleum ether/AcOEt, 9:1)
Wiley ID 1896325