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cis-5-(6-Carboxyhexyl)-trans-4-(cis-1-octenyl)-2,ref.-3-diphenylisoxazolidine
SpectraBase Compound ID 3ttbPnzmDvj
InChI InChI=1S/C30H41NO3/c1-2-3-4-5-6-15-22-27-28(23-16-7-8-17-24-29(32)33)34-31(26-20-13-10-14-21-26)30(27)25-18-11-9-12-19-25/h9-15,18-22,27-28,30H,2-8,16-17,23-24H2,1H3,(H,32,33)
InChIKey CKZNDROPOMCHCT-UHFFFAOYSA-N
Mol Weight 463.7 g/mol
Molecular Formula C30H41NO3
Exact Mass 463.308644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3Wz3yqYeGY
Name cis-5-(6-Carboxyhexyl)-trans-4-(cis-1-octenyl)-2,ref.-3-diphenylisoxazolidine
Alternate Name(s) (3s,4s,5r)-5-(6-carboxyhexyl)-4-(1-octenyl)-2,3-diphenylisoxazolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H41NO3
InChI InChI=1S/C30H41NO3/c1-2-3-4-5-6-15-22-27-28(23-16-7-8-17-24-29(32)33)34-31(26-20-13-10-14-21-26)30(27)25-18-11-9-12-19-25/h9-15,18-22,27-28,30H,2-8,16-17,23-24H2,1H3,(H,32,33)
InChIKey CKZNDROPOMCHCT-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 463.662 g/mol
SMILES OC(CCCCCCC1C(C=CCCCCCC)C(c2ccccc2)N(c2ccccc2)O1)=O
SPLASH splash10-000t-4900100000-e2c1ec46946d03e12e9f
Source of Spectrum SRH-2022-10274-0
Wiley ID 1831893