CID 54594791

3-cyclopropylcyclohexan-1-amine hydrochloride

Structural Information

Molecular Formula
C9H17N
SMILES
C1CC(CC(C1)N)C2CC2
InChI
InChI=1S/C9H17N/c10-9-3-1-2-8(6-9)7-4-5-7/h7-9H,1-6,10H2
InChIKey
HMQZOXXSWCKCAS-UHFFFAOYSA-N
Compound name
3-cyclopropylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

139.1361 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.143376 128.6
[M+Na]+ 162.125318 135.1
[M-H]- 138.128824 135.1
[M+NH4]+ 157.169923 144.8
[M+K]+ 178.099258 132.8
[M+H-H2O]+ 122.133360 122.3
[M+HCOO]- 184.134301 149.8
[M+CH3COO]- 198.149951 179.7
[M+Na-2H]- 160.110766 133.3
[M]+ 139.13555142 124.3
[M]- 139.13664858 124.3
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