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(1S,2R,4R)-7,7-dimethylbicyclo[2.2.1]heptane-1-carboxylic acid diphenylamide-1-yl 3-oxopentanoate
SpectraBase Compound ID FjGCjpcseiS
InChI InChI=1S/C27H31NO4/c1-4-22(29)18-24(30)32-23-17-19-15-16-27(23,26(19,2)3)25(31)28(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-14,19,23H,4,15-18H2,1-3H3/t19-,23?,27-/m1/s1
InChIKey FVNPFBFTNVASGP-XODLJYGDSA-N
Mol Weight 433.55 g/mol
Molecular Formula C27H31NO4
Exact Mass 433.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 86TGa0W6K9h
Name (1S,2R,4R)-7,7-dimethylbicyclo[2.2.1]heptane-1-carboxylic acid diphenylamide-1-yl 3-oxopentanoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H31NO4
InChI InChI=1S/C27H31NO4/c1-4-22(29)18-24(30)32-23-17-19-15-16-27(23,26(19,2)3)25(31)28(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-14,19,23H,4,15-18H2,1-3H3/t19-,23?,27-/m1/s1
InChIKey FVNPFBFTNVASGP-XODLJYGDSA-N
Molecular Weight 433.548 g/mol
SMILES [C@]12(C(N(c3ccccc3)c3ccccc3)=O)C([C@](CC2)(CC1OC(CC(=O)CC)=O)[H])(C)C
SPLASH splash10-001i-0000900000-d16b2707e2477d2e50bc
Source of Spectrum F-67-931-3h
Wiley ID 1685578