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8-Benzyl-3-.beta.-ethyl-3-(3-chloropropyl)hexahydrocarbazol-4-one
SpectraBase Compound ID 4TyWVRIuW0z
InChI InChI=1S/C24H28ClNO/c1-2-24(14-8-16-25)15-13-21-22(23(24)27)19-11-6-7-12-20(19)26(21)17-18-9-4-3-5-10-18/h3-7,9-12,21-22H,2,8,13-17H2,1H3/t21?,22?,24-/m1/s1
InChIKey MGWPKGPQNJYKLI-UBVWURDFSA-N
Mol Weight 381.95 g/mol
Molecular Formula C24H28ClNO
Exact Mass 381.185942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kSIG5oIMSb
Name 8-Benzyl-3-.beta.-ethyl-3-(3-chloropropyl)hexahydrocarbazol-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28ClNO
InChI InChI=1S/C24H28ClNO/c1-2-24(14-8-16-25)15-13-21-22(23(24)27)19-11-6-7-12-20(19)26(21)17-18-9-4-3-5-10-18/h3-7,9-12,21-22H,2,8,13-17H2,1H3/t21?,22?,24-/m1/s1
InChIKey MGWPKGPQNJYKLI-UBVWURDFSA-N
Molecular Weight 381.947 g/mol
SMILES C12N(c3c(C2C(=O)[C@](CC1)(CC)CCCCl)cccc3)Cc1ccccc1
SPLASH splash10-0006-9131000000-e2c0dbf06b65f577b352
Source of Spectrum J-58-6461-15
Synonyms (3S)-8-benzyl-3-(3-chloropropyl)-9-ethyl-1,2,3,4a,9,9a-hexahydro-4H-carbazol-4-one (S)-9-Benzyl-3-.beta.-ethyl-3-(3-chloropropyl)hexahydrocarbazol-4-one
Wiley ID 1360271