CID 22251448

(3,7-dimethyloct-6-en-1-yl)(methyl)amine

Structural Information

Molecular Formula
C11H23N
SMILES
CC(CCC=C(C)C)CCNC
InChI
InChI=1S/C11H23N/c1-10(2)6-5-7-11(3)8-9-12-4/h6,11-12H,5,7-9H2,1-4H3
InChIKey
MQDCNEXVTOGPAR-UHFFFAOYSA-N
Compound name
N,3,7-trimethyloct-6-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

169.18304 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.190316 145.9
[M+Na]+ 192.172258 150.1
[M-H]- 168.175764 145.5
[M+NH4]+ 187.216863 166.3
[M+K]+ 208.146198 148.9
[M+H-H2O]+ 152.180300 140.5
[M+HCOO]- 214.181241 167.2
[M+CH3COO]- 228.196891 187.3
[M+Na-2H]- 190.157706 147.9
[M]+ 169.18249142 146.1
[M]- 169.18358858 146.1
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

patents stripe