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RTI-31

View entire compound with spectra: 2 MS (GC)

RTI-31
SpectraBase Compound ID IJNYAb2eopB
InChI InChI=1S/C16H20ClNO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1
InChIKey ZEOHVQFWFVMPGM-YJNKXOJESA-N
Mol Weight 293.79 g/mol
Molecular Formula C16H20ClNO2
Exact Mass 293.118257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YWLWkVTJPV
Name RTI-31
CAS Registry Number 130342-80-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20ClNO2
InChI InChI=1S/C16H20ClNO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1
InChIKey ZEOHVQFWFVMPGM-YJNKXOJESA-N
Molecular Weight 293.794 g/mol
SMILES c1(Cl)ccc(cc1)[C@]1(C[C@@]2(CC[C@@](N2C)([C@]1(C(OC)=O)[H])[H])[H])[H]
SPLASH splash10-001j-9310000000-0ae93d7e72f9e0f4ab62
Source of Spectrum CAY-2023-324-0
Wiley ID 1888290