CID 22484521

252854-21-0

Structural Information

Molecular Formula
C10H21NO
SMILES
COCCNC1CCCCCC1
InChI
InChI=1S/C10H21NO/c1-12-9-8-11-10-6-4-2-3-5-7-10/h10-11H,2-9H2,1H3
InChIKey
PBBBLFGDZLEXBK-UHFFFAOYSA-N
Compound name
N-(2-methoxyethyl)cycloheptanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

171.16231 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.16959 137.7
[M+Na]+ 194.15153 145.0
[M+NH4]+ 189.19613 145.5
[M+K]+ 210.12547 140.4
[M-H]- 170.15503 139.8
[M+Na-2H]- 192.13698 142.7
[M]+ 171.16176 139.1
[M]- 171.16286 139.1
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