CID 86812385

Rac-(1r,2s)-2-cyclohexylcyclopropan-1-amine hydrochloride

Structural Information

Molecular Formula

C₉H₁₇N

SMILES

C1CCC(CC1)[C@@H]2C[C@H]2N

InChI

InChI=1S/C9H17N/c10-9-6-8(9)7-4-2-1-3-5-7/h7-9H,1-6,10H2/t8-,9+/m0/s1

InChIKey

ONVVLKQGFMQYMT-DTWKUNHWSA-N

Compound name

cis-(1R,2S)-2-cyclohexylcyclopropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 139.1361 Da
Monoisotopic Mass: 2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[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

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe