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Benzo[a]cyclopropa[cd]pentalene, 1,2,2a,2b,6b,6c-hexahydro-2b,6c-dimethyl-
SpectraBase Compound ID AH8ZWHB9zu8
InChI InChI=1S/C14H16/c1-13-10-6-4-3-5-9(10)11-7-8-12(13)14(11,13)2/h3-6,11-12H,7-8H2,1-2H3/t11?,12-,13+,14?/m0/s1
InChIKey XONUSJMEUBLSQJ-YIFLHPOLSA-N
Mol Weight 184.28 g/mol
Molecular Formula C14H16
Exact Mass 184.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYpkhBC5zZN
Name Benzo[a]cyclopropa[cd]pentalene, 1,2,2a,2b,6b,6c-hexahydro-2b,6c-dimethyl-
CAS Registry Number 117461-28-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16
InChI InChI=1S/C14H16/c1-13-10-6-4-3-5-9(10)11-7-8-12(13)14(11,13)2/h3-6,11-12H,7-8H2,1-2H3/t11?,12-,13+,14?/m0/s1
InChIKey XONUSJMEUBLSQJ-YIFLHPOLSA-N
Molecular Weight 184.282 g/mol
SMILES [C@@]12(C3(C(c4c2cccc4)CC[C@@]13[H])C)C
SPLASH splash10-0a4i-0900000000-ca378b15278fdb4cd4ed
Source of Spectrum F-44-78-5
Synonyms 1,2-Dimethyl-3,4-benzotricyclo[3.3.0.0(2,8)]octene 2b,6c-dimethyl-1,2,2a,2b,6b,6c-hexahydrobenzo[a]cyclopropa[cd]pentalene
Wiley ID 1181608