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2,4,12-tris(t-Butyl)-1,3,13-triphosphatetracyclo[6.2.2.1(6,9).0(5,10)]trideca-2,7,12-triene
SpectraBase Compound ID HNiN6e0IsTF
InChI InChI=1S/C22H35P3/c1-19(2,3)17-23-22(21(7,8)9)15-13-10-11-14(12-13)16(15)25(17)18(24-22)20(4,5)6/h10-11,13-16H,12H2,1-9H3/t13-,14+,15-,16+,22-,25?/m0/s1
InChIKey QBRVZKPBTWUFTF-FLEQZQQXSA-N
Mol Weight 392.4 g/mol
Molecular Formula C22H35P3
Exact Mass 392.195162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwBCxd93vXs
Name 2,4,12-tris(t-Butyl)-1,3,13-triphosphatetracyclo[6.2.2.1(6,9).0(5,10)]trideca-2,7,12-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H35P3
InChI InChI=1S/C22H35P3/c1-19(2,3)17-23-22(21(7,8)9)15-13-10-11-14(12-13)16(15)25(17)18(24-22)20(4,5)6/h10-11,13-16H,12H2,1-9H3/t13-,14+,15-,16+,22-,25?/m0/s1
InChIKey QBRVZKPBTWUFTF-FLEQZQQXSA-N
Molecular Weight 392.443 g/mol
SMILES [C@]12(P=C(C(C)(C)C)[P@]([C@]3([C@@]2([C@]2(C=C[C@@]3(C2)[H])[H])[H])[H])C(=P1)C(C)(C)C)C(C)(C)C
SPLASH splash10-0a4i-9104000000-6336bcd5bf10da8074af
Source of Spectrum K1-2001-3434-26
Synonyms 8,10,11-tritert-butyl-1,9,12-triphosphatetracyclo[6.2.2.1(3,6).0(2,7)]trideca-4,9,11-triene
Wiley ID 814383