Search MNXref
 Feedback

1-Phenylheptane

PropertiesImage
MNX_IDMNXM150145 Image of MNXM150145
referencechebi:88592
formulaC13H20
global charge0
mol weight176.303
InChIKeyLBNXAWYDQUGHGX-UHFFFAOYSA-N
InChIInChI=1S/C13H20/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5,7,10H2,1H3
SMILESCCCCCCCC1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C13H20/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5,7,10H2,1H3 Image of MNXM150145
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:7][CH2:10][C:13]1=[CH:11][CH:8]=[CH:6][CH:9]=[CH:12]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:88592
chebi:88592
LBNXAWYDQUGHGX-UHFFFAOYSA-N
1-Phenylheptane
heptylbenzene
hmdb:HMDB0061825
LBNXAWYDQUGHGX-UHFFFAOYSA-N
1-Phenylheptane
1-phenylheptane
heptylbenzene

hmdb:HMDB61825
secondary/obsolete/fantasy identifier