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8,10,12-Triphenyl-1-phosphatetracyclo[6.2.2.1(3,6).0(2,7)]trideca-9,11-diene 1-Sulfide
SpectraBase Compound ID 5iRLju34s5u
InChI InChI=1S/C30H27PS/c32-31-20-26(21-10-4-1-5-11-21)30(25-14-8-3-9-15-25,19-27(31)22-12-6-2-7-13-22)28-23-16-17-24(18-23)29(28)31/h1-15,19-20,23-24,28-29H,16-18H2/t23?,24?,28?,29?,30-,31-/m1/s1
InChIKey SAEMTIUKJXMCMZ-WTINBVHTSA-N
Mol Weight 450.58 g/mol
Molecular Formula C30H27PS
Exact Mass 450.157109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhBKYqcfs3l
Name 8,10,12-Triphenyl-1-phosphatetracyclo[6.2.2.1(3,6).0(2,7)]trideca-9,11-diene 1-Sulfide
Alternate Name(s) steroisomer 8,10,12-triphenyl-1-phosphatetracyclo[6.2.2.1(3,6).0(2,7)]trideca-9,11-diene 1-sulfide 8,9,11-triphenyl-1-phosphatetracyclo[6.2.2.1(3,6).0(2,7)]trideca-9,11-diene 1-sulfide
CAS Registry Number 113773-95-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H27PS
InChI InChI=1S/C30H27PS/c32-31-20-26(21-10-4-1-5-11-21)30(25-14-8-3-9-15-25,19-27(31)22-12-6-2-7-13-22)28-23-16-17-24(18-23)29(28)31/h1-15,19-20,23-24,28-29H,16-18H2/t23?,24?,28?,29?,30-,31-/m1/s1
InChIKey SAEMTIUKJXMCMZ-WTINBVHTSA-N
Molecular Weight 450.580 g/mol
SMILES C12[P@]3(C=C([C@](C2C2CC1CC2)(c1ccccc1)C=C3c1ccccc1)c1ccccc1)=S
SPLASH splash10-0pi0-2149000000-cba1b7abce873df6bb6d
Source of Spectrum AJ-60-1560-10
Wiley ID 1387854