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Isoazitine
SpectraBase Compound ID 5gQaBbqkdp6
InChI InChI=1S/C20H29NO/c1-13-14-4-8-19(17(13)22)9-5-15-18(2)6-3-7-20(15,12-21-11-18)16(19)10-14/h11,14-17,22H,1,3-10,12H2,2H3/t14-,15?,16?,17+,18-,19-,20-/m0/s1
InChIKey JBCDJAULWLARPB-FDVBPWAXSA-N
Mol Weight 299.46 g/mol
Molecular Formula C20H29NO
Exact Mass 299.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jDvXivUOui
Name Isoazitine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29NO
InChI InChI=1S/C20H29NO/c1-13-14-4-8-19(17(13)22)9-5-15-18(2)6-3-7-20(15,12-21-11-18)16(19)10-14/h11,14-17,22H,1,3-10,12H2,2H3/t14-,15?,16?,17+,18-,19-,20-/m0/s1
InChIKey JBCDJAULWLARPB-FDVBPWAXSA-N
Molecular Weight 299.458 g/mol
SMILES O[C@@]1(C(=C)[C@]2(CC[C@]11C([C@]34CN=C[C@@](C4CC1)(CCC3)C)C2)[H])[H]
SPLASH splash10-0002-0091000000-e4428902ecb8d3e113ca
Source of Spectrum G4-63-1139-1
Wiley ID 1608537