CID 27732

N-cyclopropyl-1,3-dimethylhexylamine

Structural Information

Molecular Formula
C11H23N
SMILES
CCCC(C)CC(C)NC1CC1
InChI
InChI=1S/C11H23N/c1-4-5-9(2)8-10(3)12-11-6-7-11/h9-12H,4-8H2,1-3H3
InChIKey
HXSAOUQBBKCEFY-UHFFFAOYSA-N
Compound name
N-(4-methylheptan-2-yl)cyclopropanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.18304 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.19032 140.7
[M+Na]+ 192.17226 146.6
[M-H]- 168.17576 144.7
[M+NH4]+ 187.21686 156.2
[M+K]+ 208.14620 144.7
[M+H-H2O]+ 152.18030 134.3
[M+HCOO]- 214.18124 162.5
[M+CH3COO]- 228.19689 190.2
[M+Na-2H]- 190.15771 143.9
[M]+ 169.18249 143.0
[M]- 169.18359 143.0
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.