CID 5364436

9-nonadecene

Structural Information

Molecular Formula

C₁₉H₃₈

SMILES

CCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C19H38/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h17,19H,3-16,18H2,1-2H3/b19-17+

InChIKey

UTPZTNSPDTWUBY-HTXNQAPBSA-N

Compound name

(E)-nonadec-9-ene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 204
Patents: 266.29736 Da
Monoisotopic Mass: 9.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	267.304636	176.4
[M+Na]+	289.286578	178.6
[M-H]-	265.290084	174.3
[M+NH4]+	284.331183	193.3
[M+K]+	305.260518	174.4
[M+H-H2O]+	249.294620	169.8
[M+HCOO]-	311.295561	196.1
[M+CH3COO]-	325.311211	205.2
[M+Na-2H]-	287.272026	176.6
[M]+	266.29681142	181.9
[M]-	266.29790858	181.9

Literature stripe

literature stripe

Patent stripe

patents stripe