CID 14525584

N,n-diethyl-3,7-dimethyl-6-octen-1-amine

Structural Information

Molecular Formula
C14H29N
SMILES
CCN(CC)CCC(C)CCC=C(C)C
InChI
InChI=1S/C14H29N/c1-6-15(7-2)12-11-14(5)10-8-9-13(3)4/h9,14H,6-8,10-12H2,1-5H3
InChIKey
WHDMOUKXLOPMBC-UHFFFAOYSA-N
Compound name
N,N-diethyl-3,7-dimethyloct-6-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

211.23 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.23728 159.4
[M+Na]+ 234.21922 162.6
[M-H]- 210.22272 160.0
[M+NH4]+ 229.26382 178.8
[M+K]+ 250.19316 162.0
[M+H-H2O]+ 194.22726 153.3
[M+HCOO]- 256.22820 180.3
[M+CH3COO]- 270.24385 199.9
[M+Na-2H]- 232.20467 159.1
[M]+ 211.22945 162.1
[M]- 211.23055 162.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe