CID 65082822

2248417-90-3

Structural Information

Molecular Formula
C10H21N
SMILES
CC1(CCCC(CC1)CN)C
InChI
InChI=1S/C10H21N/c1-10(2)6-3-4-9(8-11)5-7-10/h9H,3-8,11H2,1-2H3
InChIKey
MEFATOUBIOJTIQ-UHFFFAOYSA-N
Compound name
(4,4-dimethylcycloheptyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.1674 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.17468 132.7
[M+Na]+ 178.15662 135.6
[M-H]- 154.16012 136.2
[M+NH4]+ 173.20122 153.6
[M+K]+ 194.13056 138.0
[M+H-H2O]+ 138.16466 128.0
[M+HCOO]- 200.16560 152.1
[M+CH3COO]- 214.18125 182.2
[M+Na-2H]- 176.14207 136.8
[M]+ 155.16685 124.5
[M]- 155.16795 124.5
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.