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Pterosine B-trifluoroacetate
SpectraBase Compound ID DqphuPj2qzP
InChI InChI=1S/C16H17F3O3/c1-8-6-11-7-9(2)14(20)13(11)10(3)12(8)4-5-22-15(21)16(17,18)19/h6,9H,4-5,7H2,1-3H3/t9-/m1/s1
InChIKey WMDOSKBDMLEWAM-SECBINFHSA-N
Mol Weight 314.3 g/mol
Molecular Formula C16H17F3O3
Exact Mass 314.112979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5uEeOZF2ix
Name Pterosine B-trifluoroacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17F3O3
InChI InChI=1S/C16H17F3O3/c1-8-6-11-7-9(2)14(20)13(11)10(3)12(8)4-5-22-15(21)16(17,18)19/h6,9H,4-5,7H2,1-3H3/t9-/m1/s1
InChIKey WMDOSKBDMLEWAM-SECBINFHSA-N
Instrument Name HP 5890-5970
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1410
Molecular Weight 314.304 g/mol
SMILES c1(c(c2c(cc1C)C[C@](C2=O)(C)[H])C)CCOC(C(F)(F)F)=O
SPLASH splash10-0uxr-6962000000-a9c018629da003822e74
Source of Spectrum RCM-18-826-IV
Wiley ID 1836390