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1-Cyclopropyl-1-(1-methyl-1H-indol-3-yl)-1-phenylhept-2-yn-4-yl Acetate

View entire compound with spectra: 1 MS (GC)

1-Cyclopropyl-1-(1-methyl-1H-indol-3-yl)-1-phenylhept-2-yn-4-yl Acetate
SpectraBase Compound ID B8ShTTImksK
InChI InChI=1S/C27H29NO2/c1-4-10-23(30-20(2)29)17-18-27(22-15-16-22,21-11-6-5-7-12-21)25-19-28(3)26-14-9-8-13-24(25)26/h5-9,11-14,19,22-23H,4,10,15-16H2,1-3H3
InChIKey UAFKUQDSMRDSBH-UHFFFAOYSA-N
Mol Weight 399.53 g/mol
Molecular Formula C27H29NO2
Exact Mass 399.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jaflqCvHrc
Name 1-Cyclopropyl-1-(1-methyl-1H-indol-3-yl)-1-phenylhept-2-yn-4-yl Acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29NO2
InChI InChI=1S/C27H29NO2/c1-4-10-23(30-20(2)29)17-18-27(22-15-16-22,21-11-6-5-7-12-21)25-19-28(3)26-14-9-8-13-24(25)26/h5-9,11-14,19,22-23H,4,10,15-16H2,1-3H3
InChIKey UAFKUQDSMRDSBH-UHFFFAOYSA-N
Molecular Weight 399.534 g/mol
SMILES c1(C(C#CC(OC(=O)C)CCC)(C2CC2)c2ccccc2)c[n](C)c2c1cccc2
SPLASH splash10-0597-0907100000-63e11d1e117a9da97c51
Source of Spectrum F4-44-1879-1a
Wiley ID 1707248