CID 45186

63907-01-7

Structural Information

Molecular Formula

C₉H₁₇N

SMILES

CC1(CC2CCC1C2)NC

InChI

InChI=1S/C9H17N/c1-9(10-2)6-7-3-4-8(9)5-7/h7-8,10H,3-6H2,1-2H3

InChIKey

FYOSQQMCCODNJV-UHFFFAOYSA-N

Compound name

N,2-dimethylbicyclo[2.2.1]heptan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 139.1361 Da
Monoisotopic Mass: 1.7
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	132.0
[M+Na]+	162.125318	139.0
[M-H]-	138.128824	134.9
[M+NH4]+	157.169923	160.6
[M+K]+	178.099258	137.1
[M+H-H2O]+	122.133360	128.1
[M+HCOO]-	184.134301	154.3
[M+CH3COO]-	198.149951	177.1
[M+Na-2H]-	160.110766	137.3
[M]+	139.13555142	129.6
[M]-	139.13664858	129.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe