Results for:
PubChem ID: 10315

1-phenylbutan-1-one

Mass-Spectra

Compound Details

Synonymous names	BUTYROPHENONE 1-phenylbutan-1-one 495-40-9 n-Butyrophenone 1-Butanone, 1-phenyl- Phenyl propyl ketone 1-Phenyl-1-butanone Propyl phenyl ketone 1-Phenyl-butan-1-one NSC 8463 NSC-8463 DTXSID3047059 NSC8463 186I11WB5B MFCD00009397 Butyrophenone, >=99% Butyrophenone; 1-Phenylbutan-1-one; n-Butyrophenone UNII-186I11WB5B propylphenylketone EINECS 207-799-7 3-methylpropiophenone Phenyl n-propyl ketone AI3-02062 SCHEMBL82532 CHEMBL193524 DTXCID1027059 Butyrophenone, analytical standard NSC8463NSC 8463 Tox21_302345 BBL027757 STL373490 AKOS000120282 CS-W010981 MCULE-1952839528 PS-5615 NCGC00256194-01 CAS-495-40-9 SY011586 AM20040561 B0769 NS00012073 EN300-20322 F81498 A827738 Q421344 J-505070 W-106021 F0001-1286 Z104477742 InChI=1/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H
Microorganism:	Yes
IUPAC name	1-phenylbutan-1-one
SMILES	CCCC(=O)C1=CC=CC=C1
Inchi	InChI=1S/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3
Formula	C10H12O
PubChem ID	10315
Molweight	148.2
LogP	2.5
Atoms	11
Bonds	3
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	benzenoids aromatic compounds aromatic ketones ketones
Supernatural-ID	SN0084492

mVOC Specific Details

Massbank-Links

Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP001663 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP005655 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP006285 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP006286 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP007145

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Pseudomonas Aeruginosa NA NA Bean et al. 2012 Eukaryota Candida Albicans ATCC MYA-2876, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Glabrata ATCC 90030, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Tropicalis ATCC 750, American Type Culture Collection Costa et al. 2020 Eukaryota Chromera Velia Culture Collection of Algae and Protozoa (CCAP) at the SAMS Limited Scottish Marine Institute (Oban, Argyll, Scotland, UK) Koteska et al. 2023 Eukaryota Tuber Melanosporum T. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b Prokaryota Bacillus Subtilis NA NA Lee et al. 2023

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Pseudomonas Aeruginosa lysogeny broth SPME/GCxGC-MS no Eukaryota Candida Albicans YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Glabrata YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Tropicalis YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Chromera Velia seawater media L1 OSSA/GC-MS no Eukaryota Tuber Melanosporum yes Prokaryota Bacillus Subtilis Tryptone soy broth (TSB) HPLC no