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(1R,2S,6S,14R,15R,18R)-6,10,10,14,15-pentamethylpentacyclo[16.3.1.0(2,15).0(5,14).0(6,11)]docosane
SpectraBase Compound ID KbGP73qvgFk
InChI InChI=1S/C27H46/c1-24(2)14-7-15-25(3)22(24)13-17-27(5)23(25)11-10-21-20-9-6-8-19(18-20)12-16-26(21,27)4/h19-23H,6-18H2,1-5H3/t19-,20-,21+,22?,23?,25+,26-,27-/m1/s1
InChIKey AYQADWZQWZKSFL-HTNKTBMASA-N
Mol Weight 370.7 g/mol
Molecular Formula C27H46
Exact Mass 370.359951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGfoVwlsBVv
Name (1R,2S,6S,14R,15R,18R)-6,10,10,14,15-pentamethylpentacyclo[16.3.1.0(2,15).0(5,14).0(6,11)]docosane
CAS Registry Number 96148-65-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46
InChI InChI=1S/C27H46/c1-24(2)14-7-15-25(3)22(24)13-17-27(5)23(25)11-10-21-20-9-6-8-19(18-20)12-16-26(21,27)4/h19-23H,6-18H2,1-5H3/t19-,20+,21+,22?,23?,25+,26-,27-/m1/s1
InChIKey AYQADWZQWZKSFL-HTNKTBMASA-N
Molecular Weight 370.665 g/mol
SMILES [C@@]12([C@]3([C@@]([C@@]4(C[C@@](CC3)(CCC4)[H])[H])([H])CCC1[C@]1(CCCC(C1CC2)(C)C)C)C)C
SPLASH splash10-0006-0901000000-9ab29b160aac2e46da39
Source of Spectrum J-50-1829-17
Synonyms 1H-cyclopenta[a]chrysene, 20,29,30-trinorlupane derivative (alternate CAS name) 22,29,30-trinor-28(18-17S)abeo-13.alpha,18.beta.-hopane 22,29,30-TRINO-28(18-17S)ABEO-13.alpha.,18.alpha.-HOPANE 22,29,30-trinor-28(18-17S)abeo-13.alpha.,18.alpha.-hopane 22,29,30-TRINOR-28(18-17S)ABEO-13.ALPHA,18.beta.-HOPANE
Wiley ID 1354776