CID 15753752

3,3-dimethylcyclohexan-1-amine

Structural Information

Molecular Formula
C8H17N
SMILES
CC1(CCCC(C1)N)C
InChI
InChI=1S/C8H17N/c1-8(2)5-3-4-7(9)6-8/h7H,3-6,9H2,1-2H3
InChIKey
DUMSDLPWUAVLJQ-UHFFFAOYSA-N
Compound name
3,3-dimethylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

215
Patents

127.1361 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.14338 128.5
[M+Na]+ 150.12532 134.3
[M-H]- 126.12882 131.4
[M+NH4]+ 145.16992 152.3
[M+K]+ 166.09926 133.2
[M+H-H2O]+ 110.13336 124.1
[M+HCOO]- 172.13430 149.4
[M+CH3COO]- 186.14995 174.2
[M+Na-2H]- 148.11077 133.9
[M]+ 127.13555 122.6
[M]- 127.13665 122.6
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

patents stripe