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D:A-Friedooleanan-3-imine, N-nitro-
SpectraBase Compound ID CO0kjTk7O5k
InChI InChI=1S/C30H50N2O2/c1-20-21(31-32(33)34)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/b31-21+/t20-,22?,23?,24+,26+,27+,28-,29+,30-/m0/s1
InChIKey XYPXKUFIQWQEPL-VEQHTRABSA-N
Mol Weight 470.7 g/mol
Molecular Formula C30H50N2O2
Exact Mass 470.387229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKPzEXy1gnd
Name D:A-Friedooleanan-3-imine, N-nitro-
CAS Registry Number 53163-79-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50N2O2
InChI InChI=1S/C30H50N2O2/c1-20-21(31-32(33)34)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/b31-21+/t20-,22?,23?,24+,26+,27+,28-,29+,30-/m0/s1
InChIKey XYPXKUFIQWQEPL-VEQHTRABSA-N
Molecular Weight 470.742 g/mol
SMILES [C@@]12([C@]([C@@]3(CC(C)(C)CC[C@@]3(CC2)C)[H])(CC[C@@]2(C1CC[C@@]1([C@](\C(=N\N(=O)=O)CCC21)(C)[H])C)C)C)C
SPLASH splash10-0a4i-0944200000-d4ac7e9ea6d1f8ba8b3c
Source of Spectrum KC-1988-3265-55
Synonyms Friedelan-3-imine, N-nitro- (2E)-2-((4R,4aS,6bR,8aR,12aR,12bS,14aS)-4,4a,6b,8a,11,11,12b,14a-octamethylicosahydro-3(2H)-picenylidene)-1lambda(1)-diazane 1,1-dioxide 3-Nitriminofriedelane N-nitro-3.beta.,24-epiminofriedelane
Wiley ID 1392970