CID 57940

100535-00-0

Structural Information

Molecular Formula
C11H23N
SMILES
CCN(C)C(C)CCC=C(C)C
InChI
InChI=1S/C11H23N/c1-6-12(5)11(4)9-7-8-10(2)3/h8,11H,6-7,9H2,1-5H3
InChIKey
NXJHBKKONNZWLA-UHFFFAOYSA-N
Compound name
N-ethyl-N,6-dimethylhept-5-en-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.18304 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.19032 144.5
[M+Na]+ 192.17226 153.4
[M+NH4]+ 187.21686 152.4
[M+K]+ 208.14620 147.7
[M-H]- 168.17576 144.9
[M+Na-2H]- 190.15771 147.4
[M]+ 169.18249 145.7
[M]- 169.18359 145.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.