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13-Amino-1,4,5,8,9,12-hexamethyltriptycene
SpectraBase Compound ID 2SL1WaJXaSf
InChI InChI=1S/C26H27N/c1-13-7-9-15(3)24-21(13)23-18-11-17(5)20(27)12-19(18)26(24,6)25-16(4)10-8-14(2)22(23)25/h7-12,23H,27H2,1-6H3/t23-,26+
InChIKey VSNACAIKYMHNLT-VJXHGUGDSA-N
Mol Weight 353.51 g/mol
Molecular Formula C26H27N
Exact Mass 353.21435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YgviTMQQdn
Name 13-Amino-1,4,5,8,9,12-hexamethyltriptycene
Alternate Name(s) 1,5,10,13,16,19-hexamethylpentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15,17,19-nonaen-4-amine 1,5,10,13,16,19-hexamethylpentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15,17,19-nonaen-4-ylamine
CAS Registry Number 127309-77-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27N
InChI InChI=1S/C26H27N/c1-13-7-9-15(3)24-21(13)23-18-11-17(5)20(27)12-19(18)26(24,6)25-16(4)10-8-14(2)22(23)25/h7-12,23H,27H2,1-6H3/t23-,26+
InChIKey VSNACAIKYMHNLT-VJXHGUGDSA-N
Molecular Weight 353.509 g/mol
SMILES Nc1cc2[C@]3(c4c(c(C)ccc4C)[C@](c4c3c(ccc4C)C)(c2cc1C)[H])C
SPLASH splash10-0udr-0009000000-d9e44922639943ee3926
Source of Spectrum K-123-2151-23
Wiley ID 1344154