CID 64712235

(1s)-1-(3-methylcyclohexyl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C9H19N
SMILES
CC1CCCC(C1)[C@H](C)N
InChI
InChI=1S/C9H19N/c1-7-4-3-5-9(6-7)8(2)10/h7-9H,3-6,10H2,1-2H3/t7?,8-,9?/m0/s1
InChIKey
DJOVWJMYDZPCSB-MGURRDGZSA-N
Compound name
(1S)-1-(3-methylcyclohexyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.15175 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.15903 134.3
[M+Na]+ 164.14097 138.4
[M-H]- 140.14447 136.6
[M+NH4]+ 159.18557 155.4
[M+K]+ 180.11491 137.3
[M+H-H2O]+ 124.14901 128.9
[M+HCOO]- 186.14995 153.8
[M+CH3COO]- 200.16560 178.5
[M+Na-2H]- 162.12642 136.7
[M]+ 141.15120 127.8
[M]- 141.15230 127.8
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

No patent data available for this compound.