CID 14810387

2-methylcycloheptan-1-amine

Structural Information

Molecular Formula
C8H17N
SMILES
CC1CCCCCC1N
InChI
InChI=1S/C8H17N/c1-7-5-3-2-4-6-8(7)9/h7-8H,2-6,9H2,1H3
InChIKey
UHTCTILWSRQCBQ-UHFFFAOYSA-N
Compound name
2-methylcycloheptan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

127.1361 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.14338 125.7
[M+Na]+ 150.12532 133.9
[M+NH4]+ 145.16992 134.3
[M+K]+ 166.09926 129.7
[M-H]- 126.12882 128.3
[M+Na-2H]- 148.11077 131.0
[M]+ 127.13555 127.4
[M]- 127.13665 127.4
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