CID 22379486

[1-(aminomethyl)cyclohexyl]methanol hydrochloride

Structural Information

Molecular Formula
C8H17NO
SMILES
C1CCC(CC1)(CN)CO
InChI
InChI=1S/C8H17NO/c9-6-8(7-10)4-2-1-3-5-8/h10H,1-7,9H2
InChIKey
XEESKQOQUSLLOT-UHFFFAOYSA-N
Compound name
[1-(aminomethyl)cyclohexyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

110
Patents

143.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 133.1
[M+Na]+ 166.12023 137.4
[M-H]- 142.12373 134.0
[M+NH4]+ 161.16483 155.0
[M+K]+ 182.09417 135.8
[M+H-H2O]+ 126.12827 128.4
[M+HCOO]- 188.12921 152.7
[M+CH3COO]- 202.14486 172.5
[M+Na-2H]- 164.10568 138.6
[M]+ 143.13046 126.4
[M]- 143.13156 126.4
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