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tert-Butyl (S)-(1-(3,4-dimethoxyphenyl)-2-(2,2-dimethyl-4-oxo-4H-1,3-dioxin-6-yl)ethyl)carbamate
SpectraBase Compound ID 8Wxl3TWUBeQ
InChI InChI=1S/C21H29NO7/c1-20(2,3)29-19(24)22-15(11-14-12-18(23)28-21(4,5)27-14)13-8-9-16(25-6)17(10-13)26-7/h8-10,12,15H,11H2,1-7H3,(H,22,24)/t15-/m0/s1
InChIKey BCOIKDWPNRMLGM-HNNXBMFYSA-N
Mol Weight 407.46 g/mol
Molecular Formula C21H29NO7
Exact Mass 407.194402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6DlBMX6JbL1
Name tert-Butyl (S)-(1-(3,4-dimethoxyphenyl)-2-(2,2-dimethyl-4-oxo-4H-1,3-dioxin-6-yl)ethyl)carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO7
InChI InChI=1S/C21H29NO7/c1-20(2,3)29-19(24)22-15(11-14-12-18(23)28-21(4,5)27-14)13-8-9-16(25-6)17(10-13)26-7/h8-10,12,15H,11H2,1-7H3,(H,22,24)/t15-/m0/s1
InChIKey BCOIKDWPNRMLGM-HNNXBMFYSA-N
Literature Reference DOI 10.1002/anie.201407532
Molecular Weight 407.463 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](CC=1OC(OC(C1)=O)(C)C)(c1ccc(c(c1)OC)OC)[H]
SPLASH splash10-0005-2590000000-a0dd4d16b85058f9bc08
Source of Spectrum ACI-53-SMS-12-(S)_4q
Wiley ID 1782850