CID 6434667

Lcg 21643

Structural Information

Molecular Formula
C11H23N
SMILES
CCCC(/C=C/CC)(C(C)C)N
InChI
InChI=1S/C11H23N/c1-5-7-9-11(12,8-6-2)10(3)4/h7,9-10H,5-6,8,12H2,1-4H3/b9-7+
InChIKey
MFMVPQQYDRYYIT-VQHVLOKHSA-N
Compound name
(E)-4-propan-2-yloct-5-en-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.18304 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.19032 145.2
[M+Na]+ 192.17226 150.1
[M-H]- 168.17576 144.5
[M+NH4]+ 187.21686 165.5
[M+K]+ 208.14620 148.5
[M+H-H2O]+ 152.18030 140.5
[M+HCOO]- 214.18124 165.4
[M+CH3COO]- 228.19689 186.0
[M+Na-2H]- 190.15771 148.1
[M]+ 169.18249 144.6
[M]- 169.18359 144.6
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.