For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Acetyl-3-(1H-benzimidazol-2-ylmethylamino)-5,5-dimethyl-1-cyclohex-2-enone
SpectraBase Compound ID AToUSfBW6Yz
InChI InChI=1S/C18H21N3O2/c1-11(22)17-14(8-18(2,3)9-15(17)23)19-10-16-20-12-6-4-5-7-13(12)21-16/h4-7,19H,8-10H2,1-3H3,(H,20,21)
InChIKey GIICUIROCRKTQC-UHFFFAOYSA-N
Mol Weight 311.38 g/mol
Molecular Formula C18H21N3O2
Exact Mass 311.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B4HQ2u6s5BI
Name 2-Acetyl-3-(1H-benzimidazol-2-ylmethylamino)-5,5-dimethyl-1-cyclohex-2-enone
Alternate Name(s) 2-Acetyl-3-(1H-benzimidazol-2-ylmethylamino)-5,5-dimethyl-cyclohex-2-en-1-one 3-(1H-benzimidazol-2-ylmethylamino)-2-ethanoyl-5,5-dimethyl-cyclohex-2-en-1-one Cyclohex-2-enone, 2-acetyl-3-[(1H-benzoimidazol-2-ylmethyl)amino]-5,5-dimethyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N3O2
InChI InChI=1S/C18H21N3O2/c1-11(22)17-14(8-18(2,3)9-15(17)23)19-10-16-20-12-6-4-5-7-13(12)21-16/h4-7,19H,8-10H2,1-3H3,(H,20,21)
InChIKey GIICUIROCRKTQC-UHFFFAOYSA-N
Molecular Weight 311.385 g/mol
SMILES N(Cc1[nH]c2c(n1)cccc2)C1=C(C(=O)CC(C1)(C)C)C(C)=O
SPLASH splash10-000w-7910000000-15cfabc9e194cf30ce96
Wiley ID 1446226