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3H-Cyclobut[b]indole, 3-(cyclohexylcarbonyl)-
SpectraBase Compound ID LqNTe7RdZRN
InChI InChI=1S/C17H19NO/c19-17(12-6-2-1-3-7-12)18-15-9-5-4-8-13(15)14-10-11-16(14)18/h4-5,8-12,14,16H,1-3,6-7H2/t14-,16-/m1/s1
InChIKey SNSKPEVLBBJNOC-GDBMZVCRSA-N
Mol Weight 253.34 g/mol
Molecular Formula C17H19NO
Exact Mass 253.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKDgZnYiyyD
Name 3H-Cyclobut[b]indole, 3-(cyclohexylcarbonyl)-
CAS Registry Number 76077-46-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO
InChI InChI=1S/C17H19NO/c19-17(12-6-2-1-3-7-12)18-15-9-5-4-8-13(15)14-10-11-16(14)18/h4-5,8-12,14,16H,1-3,6-7H2/t14-,16-/m1/s1
InChIKey SNSKPEVLBBJNOC-GDBMZVCRSA-N
Molecular Weight 253.345 g/mol
SMILES [C@]12(N(c3c([C@@]2([H])C=C1)cccc3)C(=O)C1CCCCC1)[H]
SPLASH splash10-00kf-0910000000-a1e91ee8fafec20345ed
Source of Spectrum KC-1982-747-0
Synonyms (2aR,7bR)-3-(cyclohexylcarbonyl)-3,7b-dihydro-2aH-cyclobuta[b]indole cis-3-cyclohexylcarbonyl-2a,7b-dihydro-3H-cyclobut[b]-indole
Wiley ID 1256996