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(1(14)E,3S*,4R*,7S*,8S*,11R*,12R*,13R*)-7-isocyanoneoamphilect-1(14),15-diene
SpectraBase Compound ID CnHrCZaTKh8
InChI InChI=1S/C21H31N/c1-14(2)8-11-21-12-15(3)17-9-10-20(5,13-22)18(19(17)21)7-6-16(21)4/h8,11,15-19H,1,6-7,9-10,12H2,2-5H3/b11-8+/t15-,16+,17+,18-,19+,20+,21-/m0/s1
InChIKey SSFDJDHBZVHNKM-SSBPHEBUSA-N
Mol Weight 297.49 g/mol
Molecular Formula C21H31N
Exact Mass 297.24565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3tFQeTSmUC
Name (1(14)E,3S*,4R*,7S*,8S*,11R*,12R*,13R*)-7-isocyanoneoamphilect-1(14),15-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31N
InChI InChI=1S/C21H31N/c1-14(2)8-11-21-12-15(3)17-9-10-20(5,13-22)18(19(17)21)7-6-16(21)4/h8,11,15-19H,1,6-7,9-10,12H2,2-5H3/b11-8+/t15-,16+,17+,18-,19+,20+,21-/m0/s1
InChIKey SSFDJDHBZVHNKM-SSBPHEBUSA-N
Molecular Weight 297.486 g/mol
SMILES [C@@]12([C@]3([C@]([C@](C#N)(C)CC[C@]3([H])[C@](C1)(C)[H])([H])CC[C@]2(C)[H])[H])\C=C\C(=C)C
SPLASH splash10-06zi-0590000000-47c1a8edb85a999881a7
Source of Spectrum J-61-3261-15
Wiley ID 1299758