CID 15919832

8-amino-1-octanol

Structural Information

Molecular Formula
C8H19NO
SMILES
C(CCCCO)CCCN
InChI
InChI=1S/C8H19NO/c9-7-5-3-1-2-4-6-8-10/h10H,1-9H2
InChIKey
WDCOJSGXSPGNFK-UHFFFAOYSA-N
Compound name
8-aminooctan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1601
Patents

145.14667 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.15395 136.0
[M+Na]+ 168.13589 141.0
[M-H]- 144.13939 133.8
[M+NH4]+ 163.18049 156.3
[M+K]+ 184.10983 139.4
[M+H-H2O]+ 128.14393 130.9
[M+HCOO]- 190.14487 158.2
[M+CH3COO]- 204.16052 176.7
[M+Na-2H]- 166.12134 140.5
[M]+ 145.14612 135.7
[M]- 145.14722 135.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe