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

*Links on SpectraBase are not permalinks.
2-[p-(Methoxycarbonyl)benzoyl]-2-methyladamantane
SpectraBase Compound ID 6h0EcREynCR
InChI InChI=1S/C20H24O3/c1-20(16-8-12-7-13(10-16)11-17(20)9-12)18(21)14-3-5-15(6-4-14)19(22)23-2/h3-6,12-13,16-17H,7-11H2,1-2H3/t12-,13+,16-,17+,20?
InChIKey ZXLMWRMUHJYUFW-IFSREHSJSA-N
Mol Weight 312.41 g/mol
Molecular Formula C20H24O3
Exact Mass 312.172545 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 DdSIZjiBmMb
Name 2-[p-(Methoxycarbonyl)benzoyl]-2-methyladamantane
Alternate Name(s) 4-[(2-methyl-2-adamantyl)-oxomethyl]benzoic acid methyl ester Methyl 4-(2-methyladamantane-2-carbonyl)benzoate Methyl 4-[(2-methyl-2-adamantyl)carbonyl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O3
InChI InChI=1S/C20H24O3/c1-20(16-8-12-7-13(10-16)11-17(20)9-12)18(21)14-3-5-15(6-4-14)19(22)23-2/h3-6,12-13,16-17H,7-11H2,1-2H3/t12-,13+,16-,17+,20?
InChIKey ZXLMWRMUHJYUFW-IFSREHSJSA-N
Molecular Weight 312.409 g/mol
SMILES C1([C@]2(C[C@]3(C[C@@]1(C[C@@](C2)(C3)[H])[H])[H])[H])(C(c1ccc(C(=O)OC)cc1)=O)C
SPLASH splash10-01ot-2943000000-518973ee93dc313553b1
Source of Spectrum C-120-12766-5g
Wiley ID 1699997